메뉴 건너뛰기




Volumn 15, Issue 11, 2014, Pages

Competitive molecular docking approach for predicting estrogen receptor subtype α agonists and antagonists

Author keywords

[No Author keywords available]

Indexed keywords

BINDERS; BINDING ENERGY; BINS; CONFORMATIONS; INDICATORS (CHEMICAL); LIGANDS; MOLECULAR MODELING; PROTEINS; RISK ASSESSMENT; TRANSCRIPTION;

EID: 84961588282     PISSN: None     EISSN: 14712105     Source Type: Journal    
DOI: 10.1186/1471-2105-15-S11-S4     Document Type: Article
Times cited : (64)

References (69)
  • 2
    • 57349141945 scopus 로고    scopus 로고
    • Commonality in Signaling of Endocrine Disruption from Snail to Human
    • Iguchi T, Katsu Y: Commonality in Signaling of Endocrine Disruption from Snail to Human. BioScience. 2008, 58 (11): 1061-1067. 10.1641/B581109.
    • (2008) BioScience , vol.58 , Issue.11 , pp. 1061-1067
    • Iguchi, T.1    Katsu, Y.2
  • 3
    • 78651482291 scopus 로고    scopus 로고
    • Endocrine disrupting chemicals targeting estrogen receptor signaling: identification and mechanisms of action
    • Shanle EK, Xu W: Endocrine disrupting chemicals targeting estrogen receptor signaling: identification and mechanisms of action. Chem Res Toxicol. 2011, 24 (1): 6-19. 10.1021/tx100231n.
    • (2011) Chem Res Toxicol , vol.24 , Issue.1 , pp. 6-19
    • Shanle, E.K.1    Xu, W.2
  • 5
    • 0004094150 scopus 로고    scopus 로고
    • Global assessment of the state-of-the-science of endocrine disruptors.
    • WHO/PCS/EDC/02.2
    • WHO/IPCS: Global assessment of the state-of-the-science of endocrine disruptors. 2002, World Health Organization/International Program on Chemical Safety. WHO/PCS/EDC/02.2
    • (2002) World Health Organization/International Program on Chemical Safety.
  • 6
    • 74449083219 scopus 로고    scopus 로고
    • Agrichemicals in nebraska, USA, watersheds: Occurrence and endocrine effects
    • Sellin MK, Snow DD, Schwarz M, Carter BJ, Kolok AS: Agrichemicals in nebraska, USA, watersheds: Occurrence and endocrine effects. Environ Toxicol Chem. 2009, 28 (11): 2443-2448. 10.1897/09-135.1.
    • (2009) Environ Toxicol Chem , vol.28 , Issue.11 , pp. 2443-2448
    • Sellin, M.K.1    Snow, D.D.2    Schwarz, M.3    Carter, B.J.4    Kolok, A.S.5
  • 7
    • 38049080345 scopus 로고    scopus 로고
    • Endocrine-Disrupting Potential of Bisphenol A, Bisphenol A Dimethacrylate, 4-n-Nonylphenol, and 4-n-Octylphenol in Vitro: New Data and a Brief Review
    • Bonefeld EC, Long M, Hofmeister MV, Vinggaard AM: Endocrine-Disrupting Potential of Bisphenol A, Bisphenol A Dimethacrylate, 4-n-Nonylphenol, and 4-n-Octylphenol in Vitro: New Data and a Brief Review. Environ Health Perspect. 2007, 115 (Suppl 1): 69-76.
    • (2007) Environ Health Perspect , vol.115 , pp. 69-76
    • Bonefeld, E.C.1    Long, M.2    Hofmeister, M.V.3    Vinggaard, A.M.4
  • 8
    • 0017683435 scopus 로고
    • Pathological semen and anatomical abnormalities of the genital tract in human male subjects exposed to diethylstilbestrol in utero
    • Gill WB, Schumacher GF, Bibbo M: Pathological semen and anatomical abnormalities of the genital tract in human male subjects exposed to diethylstilbestrol in utero. J Urology. 1977, 117 (4): 477-480.
    • (1977) J Urology , vol.117 , Issue.4 , pp. 477-480
    • Gill, W.B.1    Schumacher, G.F.2    Bibbo, M.3
  • 9
    • 0029047149 scopus 로고
    • Persistent DDT metabolite p,p'-DDE is a potent androgen receptor antagonist
    • Kelce WR, Stone CR, Laws SC, Gray LE, Kemppainen JA, Wilson EM: Persistent DDT metabolite p,p'-DDE is a potent androgen receptor antagonist. Nature. 1995, 375 (6532): 581-585. 10.1038/375581a0.
    • (1995) Nature , vol.375 , Issue.6532 , pp. 581-585
    • Kelce, W.R.1    Stone, C.R.2    Laws, S.C.3    Gray, L.E.4    Kemppainen, J.A.5    Wilson, E.M.6
  • 10
    • 0029146597 scopus 로고
    • A variety of environmentally persistent chemicals, including some phthalate plasticizers, are weakly estrogenic
    • Jobling S, Reynolds T, White R, Parker MG, Sumpter JP: A variety of environmentally persistent chemicals, including some phthalate plasticizers, are weakly estrogenic. Enviro Health Perspect. 1995, 103 (6): 582-587. 10.1289/ehp.95103582.
    • (1995) Enviro Health Perspect , vol.103 , Issue.6 , pp. 582-587
    • Jobling, S.1    Reynolds, T.2    White, R.3    Parker, M.G.4    Sumpter, J.P.5
  • 11
    • 84934437880 scopus 로고    scopus 로고
    • Effects of environmental endocrine disruptors and phytoestrogens on the kisspeptin system
    • Patisaul HB: Effects of environmental endocrine disruptors and phytoestrogens on the kisspeptin system. Adv Exp Med Biol. 2013, 784: 455-479. 10.1007/978-1-4614-6199-9_21.
    • (2013) Adv Exp Med Biol , vol.784 , pp. 455-479
    • Patisaul, H.B.1
  • 12
    • 0038746906 scopus 로고    scopus 로고
    • Cancer and developmental exposure to endocrine disruptors
    • Birnbaum LS, Fenton SE: Cancer and developmental exposure to endocrine disruptors. Environ Health Perspect. 2003, 111 (4): 389-394.
    • (2003) Environ Health Perspect , vol.111 , Issue.4 , pp. 389-394
    • Birnbaum, L.S.1    Fenton, S.E.2
  • 13
    • 67349209522 scopus 로고    scopus 로고
    • Bisphenol A: Perinatal exposure and body weight
    • Rubin BS, Soto AM: Bisphenol A: Perinatal exposure and body weight. Mol Cell Endocrinol. 2009, 304 (1-2): 55-62. 10.1016/j.mce.2009.02.023.
    • (2009) Mol Cell Endocrinol , vol.304 , Issue.1-2 , pp. 55-62
    • Rubin, B.S.1    Soto, A.M.2
  • 14
    • 0021595614 scopus 로고
    • Fetal death and maternal occupation. An analysis of birth records in the State of Washington
    • Vaughan TL, Daling JR, Starzyk PM: Fetal death and maternal occupation. An analysis of birth records in the State of Washington. J Occup Med. 1984, 26 (9): 676-678.
    • (1984) J Occup Med , vol.26 , Issue.9 , pp. 676-678
    • Vaughan, T.L.1    Daling, J.R.2    Starzyk, P.M.3
  • 16
    • 0027290492 scopus 로고
    • Diethylstilbestrol (DES) and breast cancer
    • Malone KE: Diethylstilbestrol (DES) and breast cancer. Epidemiol Rev. 1993, 15 (1): 108-109.
    • (1993) Epidemiol Rev , vol.15 , Issue.1 , pp. 108-109
    • Malone, K.E.1
  • 17
    • 0023804651 scopus 로고
    • Cervical and vaginal cancer detection at a regional diethylstilbestrol (DES) screening clinic
    • Piver MS, Lele SB, Baker TR, Sandecki A: Cervical and vaginal cancer detection at a regional diethylstilbestrol (DES) screening clinic. Cancer Detect Prev. 1988, 11 (3-6): 197-202.
    • (1988) Cancer Detect Prev , vol.11 , Issue.3-6 , pp. 197-202
    • Piver, M.S.1    Lele, S.B.2    Baker, T.R.3    Sandecki, A.4
  • 19
    • 0016199855 scopus 로고
    • Diethylstilbestrol usage: Its interesting past, important present, and questionable future
    • Noller KL, Fish CR: Diethylstilbestrol usage: Its interesting past, important present, and questionable future. Medical Clin North Am. 1974, 58 (4): 793-810.
    • (1974) Medical Clin North Am , vol.58 , Issue.4 , pp. 793-810
    • Noller, K.L.1    Fish, C.R.2
  • 22
    • 81255188805 scopus 로고    scopus 로고
    • Endocrine disrupting chemicals and disease susceptibility
    • Schug TT, Janesick A, Blumberg B, Heindel JJ: Endocrine disrupting chemicals and disease susceptibility. J Steroid Biochem Mol Biol. 2011, 127 (3-5): 204-215. 10.1016/j.jsbmb.2011.08.007.
    • (2011) J Steroid Biochem Mol Biol , vol.127 , Issue.3-5 , pp. 204-215
    • Schug, T.T.1    Janesick, A.2    Blumberg, B.3    Heindel, J.J.4
  • 23
    • 0011156418 scopus 로고    scopus 로고
    • Tiered screening and testing strategy for xenoestrogens and antiandrogens
    • Gray LE: Tiered screening and testing strategy for xenoestrogens and antiandrogens. Toxicol Lett. 1998, 102-103: 677-680.
    • (1998) Toxicol Lett , vol.102-103 , pp. 677-680
    • Gray, L.E.1
  • 24
    • 0029908493 scopus 로고    scopus 로고
    • A Testing Deadline for Endocrine Disrupters
    • Patlak M: A Testing Deadline for Endocrine Disrupters. Environ Sci Technol. 1996, 30 (12): 540A-544A. 10.1021/es962527a.
    • (1996) Environ Sci Technol , vol.30 , Issue.12 , pp. 540A-544A
    • Patlak, M.1
  • 27
    • 0034957480 scopus 로고    scopus 로고
    • Nuclear hormone receptors and gene expression
    • Aranda A, Pascual A: Nuclear hormone receptors and gene expression. Phys Rev. 2001, 81 (3): 1269-1304.
    • (2001) Phys Rev , vol.81 , Issue.3 , pp. 1269-1304
    • Aranda, A.1    Pascual, A.2
  • 28
    • 0036156262 scopus 로고    scopus 로고
    • Prediction of estrogen receptor binding for 58,000 chemicals using an integrated system of a tree-based model with structural alerts
    • Hong H, Tong W, Fang H, Shi L, Xie Q, Wu J, Perkins R, Walker JD, Branham W, Sheehan DM: Prediction of estrogen receptor binding for 58,000 chemicals using an integrated system of a tree-based model with structural alerts. Environ Health Perspect. 2002, 110 (1): 29-36.
    • (2002) Environ Health Perspect , vol.110 , Issue.1 , pp. 29-36
    • Hong, H.1    Tong, W.2    Fang, H.3    Shi, L.4    Xie, Q.5    Wu, J.6    Perkins, R.7    Walker, J.D.8    Branham, W.9    Sheehan, D.M.10
  • 29
    • 0346504195 scopus 로고    scopus 로고
    • Regulatory application of SAR/QSAR for priority setting of endocrine disruptors: A perspective
    • Tong W, Fang H, Hong H, Xie Q, Perkins R, Anson J, Sheehan DM: Regulatory application of SAR/QSAR for priority setting of endocrine disruptors: A perspective. Pure Appl Chem. 2003, 75 (11): 2375-2388.
    • (2003) Pure Appl Chem , vol.75 , Issue.11 , pp. 2375-2388
    • Tong, W.1    Fang, H.2    Hong, H.3    Xie, Q.4    Perkins, R.5    Anson, J.6    Sheehan, D.M.7
  • 30
    • 0037923546 scopus 로고    scopus 로고
    • Development of Quantitative Structure-Activity Relationships (QSARs) and Their Use for Priority Setting in the Testing Strategy of Endocrine Disruptors
    • Tong W, Perkins R, Fang H, Hong H, Xie Q, Branham W, Sheehan DM, Anson JF: Development of Quantitative Structure-Activity Relationships (QSARs) and Their Use for Priority Setting in the Testing Strategy of Endocrine Disruptors. Regul Res Perspect. 2002, 1 (3): 1-13.
    • (2002) Regul Res Perspect , vol.1 , Issue.3 , pp. 1-13
    • Tong, W.1    Perkins, R.2    Fang, H.3    Hong, H.4    Xie, Q.5    Branham, W.6    Sheehan, D.M.7    Anson, J.F.8
  • 32
    • 0037373474 scopus 로고    scopus 로고
    • The aryl hydrocarbon receptor mediates degradation of estrogen receptor alpha through activation of proteasomes
    • Wormke M, Stoner M, Saville B, Walker K, Abdelrahim M, Burghardt R, Safe S: The aryl hydrocarbon receptor mediates degradation of estrogen receptor alpha through activation of proteasomes. Mol Cell Biol. 2003, 23 (6): 1843-1855. 10.1128/MCB.23.6.1843-1855.2003.
    • (2003) Mol Cell Biol , vol.23 , Issue.6 , pp. 1843-1855
    • Wormke, M.1    Stoner, M.2    Saville, B.3    Walker, K.4    Abdelrahim, M.5    Burghardt, R.6    Safe, S.7
  • 33
    • 57749178899 scopus 로고    scopus 로고
    • Non-classical genomic estrogen receptor (ER)/specificity protein and ER/activating protein-1 signaling pathways
    • Safe S, Kim K: Non-classical genomic estrogen receptor (ER)/specificity protein and ER/activating protein-1 signaling pathways. J Mol Endocrinol. 2008, 41 (5): 263-275. 10.1677/JME-08-0103.
    • (2008) J Mol Endocrinol , vol.41 , Issue.5 , pp. 263-275
    • Safe, S.1    Kim, K.2
  • 34
    • 84893318795 scopus 로고    scopus 로고
    • Steroid signaling: Ligand-binding promiscuity, molecular symmetry, and the need for gating
    • Lathe R, Kotelevtsev Y: Steroid signaling: Ligand-binding promiscuity, molecular symmetry, and the need for gating. Steroids. 2014, 82c: 14-22.
    • (2014) Steroids , vol.82c , pp. 14-22
    • Lathe, R.1    Kotelevtsev, Y.2
  • 36
    • 33644699019 scopus 로고    scopus 로고
    • Lessons learnt from structural studies of the oestrogen receptor
    • Pike AC: Lessons learnt from structural studies of the oestrogen receptor. Best Pract Research. 2006, 20 (1): 1-14. 10.1016/j.beem.2005.09.002.
    • (2006) Best Pract Research , vol.20 , Issue.1 , pp. 1-14
    • Pike, A.C.1
  • 38
    • 33645940621 scopus 로고    scopus 로고
    • Endocrine-disrupting compounds: a review of their challenge to sustainable and safe water supply and water reuse
    • Falconer IR, Chapman HF, Moore MR, Ranmuthugala G: Endocrine-disrupting compounds: a review of their challenge to sustainable and safe water supply and water reuse. Environ Toxicol. 2006, 21 (2): 181-191. 10.1002/tox.20172.
    • (2006) Environ Toxicol , vol.21 , Issue.2 , pp. 181-191
    • Falconer, I.R.1    Chapman, H.F.2    Moore, M.R.3    Ranmuthugala, G.4
  • 39
    • 84875898588 scopus 로고    scopus 로고
    • State of the science of endocrine disruptors
    • Birnbaum LS: State of the science of endocrine disruptors. Environ Health Perspect. 2013, 121 (4): A107-10.1289/ehp.1306695.
    • (2013) Environ Health Perspect , vol.121 , Issue.4 , pp. A107
    • Birnbaum, L.S.1
  • 40
    • 8844263008 scopus 로고    scopus 로고
    • Docking and scoring in virtual screening for drug discovery: methods and applications
    • Kitchen DB, Decornez H, Furr JR, Bajorath J: Docking and scoring in virtual screening for drug discovery: methods and applications. Nat Rev Drug Discov. 2004, 3 (11): 935-949. 10.1038/nrd1549.
    • (2004) Nat Rev Drug Discov , vol.3 , Issue.11 , pp. 935-949
    • Kitchen, D.B.1    Decornez, H.2    Furr, J.R.3    Bajorath, J.4
  • 41
    • 84882809589 scopus 로고    scopus 로고
    • Identification of putative estrogen receptor-mediated endocrine disrupting chemicals using QSAR- and structure-based virtual screening approaches
    • Zhang L, Sedykh A, Tripathi A, Zhu H, Afantitis A, Mouchlis VD, Melagraki G, Rusyn I, Tropsha A: Identification of putative estrogen receptor-mediated endocrine disrupting chemicals using QSAR- and structure-based virtual screening approaches. Toxicol Appl Pharmacol. 2013, 272 (1): 67-76. 10.1016/j.taap.2013.04.032.
    • (2013) Toxicol Appl Pharmacol , vol.272 , Issue.1 , pp. 67-76
    • Zhang, L.1    Sedykh, A.2    Tripathi, A.3    Zhu, H.4    Afantitis, A.5    Mouchlis, V.D.6    Melagraki, G.7    Rusyn, I.8    Tropsha, A.9
  • 42
    • 0242577782 scopus 로고    scopus 로고
    • CoMFA and docking study of novel estrogen receptor subtype selective ligands
    • Wolohan P, Reichert DE: CoMFA and docking study of novel estrogen receptor subtype selective ligands. J Comput Aided Mol Des. 2003, 17 (5-6): 313-328.
    • (2003) J Comput Aided Mol Des , vol.17 , Issue.5-6 , pp. 313-328
    • Wolohan, P.1    Reichert, D.E.2
  • 43
    • 0038798604 scopus 로고    scopus 로고
    • Nuclear hormone receptor targeted virtual screening
    • Schapira M, Abagyan R, Totrov M: Nuclear hormone receptor targeted virtual screening. J Med Chem. 2003, 46 (14): 3045-3059. 10.1021/jm0300173.
    • (2003) J Med Chem , vol.46 , Issue.14 , pp. 3045-3059
    • Schapira, M.1    Abagyan, R.2    Totrov, M.3
  • 44
    • 33750991346 scopus 로고    scopus 로고
    • Benchmarking sets for molecular docking
    • Huang N, Shoichet BK, Irwin JJ: Benchmarking sets for molecular docking. J Med Chem. 2006, 49 (23): 6789-6801. 10.1021/jm0608356.
    • (2006) J Med Chem , vol.49 , Issue.23 , pp. 6789-6801
    • Huang, N.1    Shoichet, B.K.2    Irwin, J.J.3
  • 45
    • 19044365588 scopus 로고    scopus 로고
    • An integrated "4-phase" approach for setting endocrine disruption screening priorities--phase I and II predictions of estrogen receptor binding affinity
    • Shi L, Tong W, Fang H, Xie Q, Hong H, Perkins R, Wu J, Tu M, Blair RM, Branham WS: An integrated "4-phase" approach for setting endocrine disruption screening priorities--phase I and II predictions of estrogen receptor binding affinity. SAR QSAR Environ Res. 2002, 13 (1): 69-88. 10.1080/10629360290002235.
    • (2002) SAR QSAR Environ Res , vol.13 , Issue.1 , pp. 69-88
    • Shi, L.1    Tong, W.2    Fang, H.3    Xie, Q.4    Hong, H.5    Perkins, R.6    Wu, J.7    Tu, M.8    Blair, R.M.9    Branham, W.S.10
  • 46
    • 0037365123 scopus 로고    scopus 로고
    • Decision forest: combining the predictions of multiple independent decision tree models
    • Tong W, Hong H, Fang H, Xie Q, Perkins R: Decision forest: combining the predictions of multiple independent decision tree models. J Chem Inf Comput Sci. 2003, 43 (2): 525-531. 10.1021/ci020058s.
    • (2003) J Chem Inf Comput Sci , vol.43 , Issue.2 , pp. 525-531
    • Tong, W.1    Hong, H.2    Fang, H.3    Xie, Q.4    Perkins, R.5
  • 47
    • 49449098592 scopus 로고    scopus 로고
    • Mold(2), molecular descriptors from 2D structures for chemoinformatics and toxicoinformatics
    • Hong H, Xie Q, Ge W, Qian F, Fang H, Shi L, Su Z, Perkins R, Tong W: Mold(2), molecular descriptors from 2D structures for chemoinformatics and toxicoinformatics. J Chem Inf Model. 2008, 48 (7): 1337-1344. 10.1021/ci800038f.
    • (2008) J Chem Inf Model , vol.48 , Issue.7 , pp. 1337-1344
    • Hong, H.1    Xie, Q.2    Ge, W.3    Qian, F.4    Fang, H.5    Shi, L.6    Su, Z.7    Perkins, R.8    Tong, W.9
  • 48
    • 0344553518 scopus 로고    scopus 로고
    • Comparative molecular field analysis (CoMFA) model using a large diverse set of natural, synthetic and environmental chemicals for binding to the androgen receptor
    • Hong H, Fang H, Xie Q, Perkins R, Sheehan DM, Tong W: Comparative molecular field analysis (CoMFA) model using a large diverse set of natural, synthetic and environmental chemicals for binding to the androgen receptor. SAR QSAR Environ Res. 2003, 14 (5-6): 373-388. 10.1080/10629360310001623962.
    • (2003) SAR QSAR Environ Res , vol.14 , Issue.5-6 , pp. 373-388
    • Hong, H.1    Fang, H.2    Xie, Q.3    Perkins, R.4    Sheehan, D.M.5    Tong, W.6
  • 50
    • 0032568527 scopus 로고    scopus 로고
    • Crystallographic comparison of the estrogen and progesterone receptor's ligand binding domains
    • Tanenbaum DM, Wang Y, Williams SP, Sigler PB: Crystallographic comparison of the estrogen and progesterone receptor's ligand binding domains. Proc Natl Acad Sci USA. 1998, 95 (11): 5998-6003. 10.1073/pnas.95.11.5998.
    • (1998) Proc Natl Acad Sci USA , vol.95 , Issue.11 , pp. 5998-6003
    • Tanenbaum, D.M.1    Wang, Y.2    Williams, S.P.3    Sigler, P.B.4
  • 52
    • 0035805514 scopus 로고    scopus 로고
    • Crystal structure of a mutant hERalpha ligand-binding domain reveals key structural features for the mechanism of partial agonism
    • Gangloff M, Ruff M, Eiler S, Duclaud S, Wurtz JM, Moras D: Crystal structure of a mutant hERalpha ligand-binding domain reveals key structural features for the mechanism of partial agonism. J Biol Chem. 2001, 276 (18): 15059-15065. 10.1074/jbc.M009870200.
    • (2001) J Biol Chem , vol.276 , Issue.18 , pp. 15059-15065
    • Gangloff, M.1    Ruff, M.2    Eiler, S.3    Duclaud, S.4    Wurtz, J.M.5    Moras, D.6
  • 53
    • 84961646312 scopus 로고    scopus 로고
    • Schrödinger, LLC, version 9.7
    • Maestro. Schrödinger, LLC, version 9.7
    • Maestro.
  • 55
    • 77955709186 scopus 로고    scopus 로고
    • Towards the comprehensive, rapid, and accurate prediction of the favorable tautomeric states of drug-like molecules in aqueous solution
    • Greenwood JR, Calkins D, Sullivan AP, Shelley JC: Towards the comprehensive, rapid, and accurate prediction of the favorable tautomeric states of drug-like molecules in aqueous solution. J Comput Aided Mol Des. 2010, 24 (6-7): 591-604. 10.1007/s10822-010-9349-1.
    • (2010) J Comput Aided Mol Des , vol.24 , Issue.6-7 , pp. 591-604
    • Greenwood, J.R.1    Calkins, D.2    Sullivan, A.P.3    Shelley, J.C.4
  • 56
    • 84885333980 scopus 로고    scopus 로고
    • Homology modeling, molecular docking, and molecular dynamics simulations elucidated alpha-fetoprotein binding modes
    • Shen J, Zhang W, Fang H, Perkins R, Tong W, Hong H: Homology modeling, molecular docking, and molecular dynamics simulations elucidated alpha-fetoprotein binding modes. BMC Bioinformatics. 2013, 14 (Suppl 14): S6-10.1186/1471-2105-14-S14-S6.
    • (2013) BMC Bioinformatics , vol.14 , pp. S6
    • Shen, J.1    Zhang, W.2    Fang, H.3    Perkins, R.4    Tong, W.5    Hong, H.6
  • 57
  • 58
    • 33747466839 scopus 로고    scopus 로고
    • Structure-function relationship of estrogen receptor alpha and beta: impact on human health
    • Ascenzi P, Bocedi A, Marino M: Structure-function relationship of estrogen receptor alpha and beta: impact on human health. Mol Aspects Med. 2006, 27 (4): 299-402. 10.1016/j.mam.2006.07.001.
    • (2006) Mol Aspects Med , vol.27 , Issue.4 , pp. 299-402
    • Ascenzi, P.1    Bocedi, A.2    Marino, M.3
  • 59
    • 33748276474 scopus 로고    scopus 로고
    • Protein-ligand docking: current status and future challenges
    • Sousa SF, Fernandes PA, Ramos MJ: Protein-ligand docking: current status and future challenges. Proteins. 2006, 65 (1): 15-26. 10.1002/prot.21082.
    • (2006) Proteins , vol.65 , Issue.1 , pp. 15-26
    • Sousa, S.F.1    Fernandes, P.A.2    Ramos, M.J.3
  • 60
    • 33645961330 scopus 로고    scopus 로고
    • Flexible protein-protein docking
    • Bonvin AMJJ: Flexible protein-protein docking. Curr Opin Struct Biol. 2006, 16 (2): 194-200. 10.1016/j.sbi.2006.02.002.
    • (2006) Curr Opin Struct Biol , vol.16 , Issue.2 , pp. 194-200
    • Bonvin, A.M.J.J.1
  • 63
    • 0033198735 scopus 로고    scopus 로고
    • Structure of the ligand-binding domain of oestrogen receptor beta in the presence of a partial agonist and a full antagonist
    • Pike AC, Brzozowski AM, Hubbard RE, Bonn T, Thorsell AG, Engstrom O, Ljunggren J, Gustafsson JA, Carlquist M: Structure of the ligand-binding domain of oestrogen receptor beta in the presence of a partial agonist and a full antagonist. EMBO J. 1999, 18 (17): 4608-4618. 10.1093/emboj/18.17.4608.
    • (1999) EMBO J , vol.18 , Issue.17 , pp. 4608-4618
    • Pike, A.C.1    Brzozowski, A.M.2    Hubbard, R.E.3    Bonn, T.4    Thorsell, A.G.5    Engstrom, O.6    Ljunggren, J.7    Gustafsson, J.A.8    Carlquist, M.9
  • 64
    • 79957708369 scopus 로고    scopus 로고
    • Structure of estradiol metal chelate and estrogen receptor complex: the basis for designing a new class of selective estrogen receptor modulators
    • Li MJ, Greenblatt HM, Dym O, Albeck S, Pais A, Pais A Fau, Gunanathan C, Milstein D, Degani H, Sussman JL: Structure of estradiol metal chelate and estrogen receptor complex: the basis for designing a new class of selective estrogen receptor modulators. J Med Chem. 2011, 54 (10): 3575-3580. 10.1021/jm200192y.
    • (2011) J Med Chem , vol.54 , Issue.10 , pp. 3575-3580
    • Li, M.J.1    Greenblatt, H.M.2    Dym, O.3    Albeck, S.4    Pais, A.5    Pais, A.F.6    Gunanathan, C.7    Milstein, D.8    Degani, H.9    Sussman, J.L.10
  • 65
    • 0032446607 scopus 로고    scopus 로고
    • The structural basis of estrogen receptor/coactivator recognition and the antagonism of this interaction by tamoxifen
    • Shiau AK, Barstad D, Loria PM, Cheng L, Kushner PJ, Agard DA, Greene GL: The structural basis of estrogen receptor/coactivator recognition and the antagonism of this interaction by tamoxifen. Cell. 1998, 95 (7): 927-937. 10.1016/S0092-8674(00)81717-1.
    • (1998) Cell , vol.95 , Issue.7 , pp. 927-937
    • Shiau, A.K.1    Barstad, D.2    Loria, P.M.3    Cheng, L.4    Kushner, P.J.5    Agard, D.A.6    Greene, G.L.7
  • 68
    • 84866274611 scopus 로고    scopus 로고
    • Structural and mechanistic insights into bisphenols action provide guidelines for risk assessment and discovery of bisphenol A substitutes
    • Delfosse V, Grimaldi M, Pons JL, Boulahtouf A, le Maire A, Cavailles V, Labesse G, Bourguet W, Balaguer P: Structural and mechanistic insights into bisphenols action provide guidelines for risk assessment and discovery of bisphenol A substitutes. Proc Natl Acad Sci USA. 2012, 109 (37): 14930-14935. 10.1073/pnas.1203574109.
    • (2012) Proc Natl Acad Sci USA , vol.109 , Issue.37 , pp. 14930-14935
    • Delfosse, V.1    Grimaldi, M.2    Pons, J.L.3    Boulahtouf, A.4    le Maire, A.5    Cavailles, V.6    Labesse, G.7    Bourguet, W.8    Balaguer, P.9
  • 69
    • 33750982700 scopus 로고    scopus 로고
    • Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods
    • Li H, Ung CY, Yap CW, Xue Y, Li ZR, Chen YZ: Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. J Mol Graph Model. 2006, 25 (3): 313-323. 10.1016/j.jmgm.2006.01.007.
    • (2006) J Mol Graph Model , vol.25 , Issue.3 , pp. 313-323
    • Li, H.1    Ung, C.Y.2    Yap, C.W.3    Xue, Y.4    Li, Z.R.5    Chen, Y.Z.6


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.