-
3
-
-
0034739474
-
2 and their receptor and protein binding proteins
-
1:CAS:528:DC%2BD3cXotlGisbc%3D
-
2 and their receptor and protein binding proteins Biochim Biophys Acta - Mol Cell Bio Lip 1488 59 70 1:CAS:528: DC%2BD3cXotlGisbc%3D
-
(2000)
Biochim Biophys Acta - Mol Cell Bio Lip
, vol.1488
, pp. 59-70
-
-
Valentin, E.1
Lambeau, G.2
-
6
-
-
0034737824
-
2: A newly recognized acute-phase reactant with a role in atherogenesis
-
2: a newly recognized acute-phase reactant with a role in atherogenesis Circ Res 86 610 612 1:CAS:528:DC%2BD3cXitlajsb8%3D (Pubitemid 30208425)
-
(2000)
Circulation Research
, vol.86
, Issue.6
, pp. 610-612
-
-
Kovanen, P.T.1
Pentikainen, M.O.2
-
7
-
-
0021989439
-
2 in normal human epidermis and in lesion-free epidermis of patients with psoriasis or eczema
-
DOI 10.1111/j.1365-2133.1985.tb00077.x
-
2 in normal human epidermis and in lesion-free epidermis of patients with psoriasis or eczema Br J Dermatol 112 135 147 10.1111/j.1365-2133.1985.tb00077.x 1:STN:280: DyaL2M7it1Crug%3D%3D (Pubitemid 15165804)
-
(1985)
British Journal of Dermatology
, vol.112
, Issue.2
, pp. 135-147
-
-
Forster, S.1
Ilderton, E.2
Norris, J.F.B.3
-
8
-
-
0028081488
-
2 in colonic mucosa of patients with Crohn's disease and ulcerative colitis
-
2 in colonic mucosa of patients with Crohn's disease and ulcerative colitis Gut 35 1593 1598 10.1136/gut.35.11.1593 1:STN:280:DyaK2M7ivF2ltA%3D%3D (Pubitemid 24339259)
-
(1994)
Gut
, vol.35
, Issue.11
, pp. 1593-1598
-
-
Minami, T.1
Tojo, H.2
Shinomura, Y.3
Matsuzawa, Y.4
Okamoto, M.5
-
10
-
-
13844307284
-
2. 2-Synthesis and structure-activity relationship studies of 4,5-dihydro-3-(4-tetradecyloxybenzyl) -1,2,4-4H-oxadiazol-5-one (PMS1062) derivatives specific for group II enzyme
-
DOI 10.1016/j.bmc.2005.01.016
-
CZ Dong AA Himidi S Plocki D Aoun M Touaibia NM Habich J Huet C Redeuilh JE Ombetta JJ Godfroid F Massicota F Heymans 2005 Bioorg Med Chem 13 1989 2007 10.1016/j.bmc.2005.01.016 1:CAS:528:DC%2BD2MXhsFSjsbw%3D (Pubitemid 40261121)
-
(2005)
Bioorganic and Medicinal Chemistry
, vol.13
, Issue.6
, pp. 1989-2007
-
-
Dong, C.-Z.1
Ahamada-Himidi, A.2
Plocki, S.3
Aoun, D.4
Touaibia, M.5
Meddad-Bel Habich, N.6
Huet, J.7
Redeuilh, C.8
Ombetta, J.-E.9
Godfroid, J.-J.10
Massicot, F.11
Heymans, F.12
-
11
-
-
33644841098
-
2 with niflumic acid at 2.5 A resolution
-
DOI 10.1107/S0907444905029604
-
2 with niflumic acid at 2.5 angstroms resolution Acta Crystallogr D Biol Crystallogr 61 1579 1586 10.1107/S0907444905029604 (Pubitemid 43943115)
-
(2005)
Acta Crystallographica Section D: Biological Crystallography
, vol.61
, Issue.12
, pp. 1579-1586
-
-
Jabeen, T.1
Singh, N.2
Singh, R.K.3
Sharma, S.4
Somvanshi, R.K.5
Dey, S.6
Singh, T.P.7
-
12
-
-
33750712502
-
In silico-guided target identification of a scaffold-focused library: 1,3,5-Triazepan-2,6-diones as novel phospholipase A2 inhibitors
-
DOI 10.1021/jm0606589
-
P Muller G Lena E Boilard S Bezzine G Lambeau G Guichard D Rognan 2006 In silico-guided target identification of a scaffold-focused library: 1, 3, 5-triazepan-2, 6-diones as novel phospholipase A2 inhibitors J Med Chem 49 6768 6778 10.1021/jm0606589 1:CAS:528:DC%2BD28XhtVOqsLfP (Pubitemid 44749744)
-
(2006)
Journal of Medicinal Chemistry
, vol.49
, Issue.23
, pp. 6768-6778
-
-
Muller, P.1
Lena, G.2
Boilard, E.3
Bezzine, S.4
Lambeau, G.5
Guichard, G.6
Rognan, D.7
-
13
-
-
12644258541
-
2. 1. Indole-3-acetamides
-
DOI 10.1021/jm960485v
-
2. 1. Indole-3-acetamides J Med Chem 39 5119 5136 10.1021/jm960485v 1:CAS:528:DyaK28XntFejt7Y%3D (Pubitemid 27008959)
-
(1996)
Journal of Medicinal Chemistry
, vol.39
, Issue.26
, pp. 5119-5136
-
-
Dillard, R.D.1
Bach, N.J.2
Draheim, S.E.3
Berry, D.R.4
Carlson, D.G.5
Chirgadze, N.Y.6
Clawson, D.K.7
Hartley, L.W.8
Johnson, L.M.9
Jones, N.D.10
McKinney, E.R.11
Mihelich, E.D.12
Olkowski, J.L.13
Schevitz, R.W.14
Smith, A.C.15
Snyder, D.W.16
Sommers, C.D.17
Wery, J.-P.18
-
14
-
-
12644249111
-
2. 2. Indole-3-acetamides with additional functionality
-
DOI 10.1021/jm960486n
-
2. 2. Indole-3-acetamides with additional functionality J Med Chem 39 5137 5158 10.1021/jm960486n 1:CAS:528:DyaK28XntFejt7c%3D (Pubitemid 27008960)
-
(1996)
Journal of Medicinal Chemistry
, vol.39
, Issue.26
, pp. 5137-5158
-
-
Dillard, R.D.1
Bach, N.J.2
Draheim, S.E.3
Berry, D.R.4
Carlson, D.G.5
Chirgadze, N.Y.6
Clawson, D.K.7
Hartley, L.W.8
Johnson, L.M.9
Jones, N.D.10
McKinney, E.R.11
Mihelich, E.D.12
Olkowski, J.L.13
Schevitz, R.W.14
Smith, A.C.15
Snyder, D.W.16
Sommers, C.D.17
Wery, J.-P.18
-
15
-
-
12644262408
-
2. 3. Indole-3-glyoxamides
-
DOI 10.1021/jm960487f
-
2. 3. Indole-3-glyoxamides J Med Chem 39 5159 5175 10.1021/jm960487f 1:CAS:528:DyaK28XntFejtL4%3D (Pubitemid 27008961)
-
(1996)
Journal of Medicinal Chemistry
, vol.39
, Issue.26
, pp. 5159-5175
-
-
Draheim, S.E.1
Bach, N.J.2
Dillard, R.D.3
Berry, D.R.4
Carlson, D.G.5
Chirgadze, N.Y.6
Clawson, D.K.7
Hartley, L.W.8
Johnson, L.M.9
Jones, N.D.10
McKinney, E.R.11
Mihelich, E.D.12
Olkowski, J.L.13
Schevitz, R.W.14
Smith, A.C.15
Snyder, D.W.16
Sommers, C.D.17
Wery, J.-P.18
-
17
-
-
0035492205
-
2 inhibition: Syntheses and structure-activity relationships in 1-arylsulfamido-2-alkylpiperazines
-
DOI 10.1016/S0223-5234(01)01274-0, PII S0223523401012740
-
2 inhibition: syntheses and structure-activity relationships in 1-arylsulfamido-2-alkylpiperazines Eur J Med Chem 36 809 828 10.1016/S0223-5234(01)01274-0 1:CAS:528:DC%2BD3MXptVSisbg%3D (Pubitemid 34001626)
-
(2001)
European Journal of Medicinal Chemistry
, vol.36
, Issue.10
, pp. 809-828
-
-
Binisti, C.1
Assogba, L.2
Touboul, E.3
Mounier, C.4
Huet, J.5
Ombetta, J.-E.6
Dong, C.Z.7
Redeuilh, C.8
Heymans, F.9
Godfroid, J.-J.10
-
18
-
-
0023751431
-
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
-
10.1021/ja00226a005 1:CAS:528:DyaL1cXltVCqsbs%3D
-
RD Cramer DE Patterson JD Bunce 1988 Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins J Am Chem Soc 110 5959 5967 10.1021/ja00226a005 1:CAS:528:DyaL1cXltVCqsbs%3D
-
(1988)
J Am Chem Soc
, vol.110
, pp. 5959-5967
-
-
Cramer, R.D.1
Patterson, D.E.2
Bunce, J.D.3
-
19
-
-
0027944195
-
Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity
-
DOI 10.1021/jm00050a010
-
G Klebe U Abraham T Mietzner 1994 Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity J Med Chem 37 4130 4146 10.1021/jm00050a010 1:CAS:528:DyaK2cXmslWhu7Y%3D (Pubitemid 24379702)
-
(1994)
Journal of Medicinal Chemistry
, vol.37
, Issue.24
, pp. 4130-4146
-
-
Klebe, G.1
Abraham, U.2
Mietzner, T.3
-
20
-
-
0024716284
-
Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. 4. Additional parameters for hydrophobic and dispersive interactions and their application for an automated superposition of certain naturally occurring nucleoside antibiotics
-
N Vellarkad VN Viswanadhan AK Ghose R Revenkar RN Robins 1989 Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. 4. Additional parameters for hydrophobic and dispersive interactions and their application for an automated superposition of certain naturally occurring nucleoside antibiotics J Chem Inf Comput Sci 29 163 172
-
(1989)
J Chem Inf Comput Sci
, vol.29
, pp. 163-172
-
-
Vellarkad, N.1
Viswanadhan, V.N.2
Ghose, A.K.3
Revenkar, R.4
Robins, R.N.5
-
22
-
-
33750330064
-
2D and 3D quantitative structure-activity relationship studies on a series of bis-pyridinium compounds as choline kinase inhibitors
-
DOI 10.1002/qsar.200530199
-
S Janardhan P Srivani GN Sastry 2006 2D and 3D quantitative structure-activity relationship studies on a series of bis-pyridinium compounds as choline kinase inhibitors QSAR Comb Sci 25 860 872 10.1002/qsar.200530199 1:CAS:528:DC%2BD28XhtFKksbfM (Pubitemid 44621663)
-
(2006)
QSAR and Combinatorial Science
, vol.25
, Issue.10
, pp. 860-872
-
-
Janardhan, S.1
Srivani, P.2
Sastry, G.N.3
-
23
-
-
34347257750
-
Molecular modeling studies of pyridopurinone derivatives-Potential phosphodiesterase 5 inhibitors
-
DOI 10.1016/j.jmgm.2007.01.007, PII S1093326307000083
-
P Srivani E Srinivas R Raghu GN Sastry 2007 Molecular modeling studies of pyridopurinone derivatives - Potential phosphodiesterase 5 Inhibitors J Mol Graph Model 26 378 390 10.1016/j.jmgm.2007.01.007 1:CAS:528:DC%2BD2sXntFyns7o%3D (Pubitemid 46992725)
-
(2007)
Journal of Molecular Graphics and Modelling
, vol.26
, Issue.1
, pp. 378-390
-
-
Srivani, P.1
Srinivas, E.2
Raghu, R.3
Sastry, G.N.4
-
24
-
-
34047158651
-
Strategies to design pyrazolyl urea derivatives for p38 kinase inhibition: A molecular modeling study
-
DOI 10.1007/s10822-006-9092-9
-
RG Kulkarni P Srivani G Achaiah GN Sastry 2007 Strategies to design of pyrazolyl urea derivatives for p38 kinase inhibition: a molecular modeling study J Comput Aided Mol Design 25 155 166 10.1007/s10822-006-9092-9 (Pubitemid 46510841)
-
(2007)
Journal of Computer-Aided Molecular Design
, vol.21
, Issue.4
, pp. 155-166
-
-
Kulkarni, R.G.1
Srivani, P.2
Achaiah, G.3
Sastry, G.N.4
-
25
-
-
41249089027
-
Molecular modeling studies of phenoxypyrimidinyl imidazoles as p38 kinase inhibitors using QSAR and docking
-
DOI 10.1016/j.ejmech.2007.06.009, PII S0223523407002589
-
RG Kulkarni G Achaiah GN Sastry 2008 Molecular modeling studies of phenoxypyrimidinyl imidazoles as p38 kinase inhibitors using QSAR and docking Eur J Med Chem 43 830 838 10.1016/j.ejmech.2007.06.009 (Pubitemid 351446153)
-
(2008)
European Journal of Medicinal Chemistry
, vol.43
, Issue.4
, pp. 830-838
-
-
Ravindra, G.K.1
Achaiah, G.2
Sastry, G.N.3
-
26
-
-
58849121494
-
Potential choline kinase inhibitors: A molecular modeling study of bis-quinolinium compounds
-
10.1016/j.jmgm.2008.10.010 1:CAS:528:DC%2BD1MXhtlCksbY%3D
-
P Srivani GN Sastry 2009 Potential choline kinase inhibitors: a molecular modeling study of bis-quinolinium compounds J Mol Graph Model 27 676 688 10.1016/j.jmgm.2008.10.010 1:CAS:528:DC%2BD1MXhtlCksbY%3D
-
(2009)
J Mol Graph Model
, vol.27
, pp. 676-688
-
-
Srivani, P.1
Sastry, G.N.2
-
27
-
-
79958174812
-
-
SYBYL 6.9. Molecular Modeling Software, Tripos Inc, 1699 Hanley Road, St Louis, MO 63144
-
SYBYL 6.9. Molecular Modeling Software, Tripos Inc, 1699 Hanley Road, St Louis, MO 63144
-
-
-
-
28
-
-
0030599010
-
A fast flexible docking method using an incremental construction algorithm
-
DOI 10.1006/jmbi.1996.0477
-
M Rarey B Kramer T Lengauer G Klebe 1996 A fast flexible docking method using an incremental construction algorithm J Mol Biol 261 470 489 10.1006/jmbi.1996.0477 1:CAS:528:DyaK28XltlKisLo%3D (Pubitemid 26335901)
-
(1996)
Journal of Molecular Biology
, vol.261
, Issue.3
, pp. 470-489
-
-
Rarey, M.1
Kramer, B.2
Lengauer, T.3
Klebe, G.4
-
29
-
-
79958134475
-
-
GOLD, version 2.1; Cambridge Crystallographic Data Centre: Cambridge, UK
-
GOLD, version 2.1; Cambridge Crystallographic Data Centre: Cambridge, UK
-
-
-
-
30
-
-
0031552362
-
Development and validation of a genetic algorithm for flexible docking
-
DOI 10.1006/jmbi.1996.0897
-
G Jones P Willet RC Glen AR Leach R Taylor 1997 Development and validation of a genetic algorithm for flexible docking J Mol Biol 267 727 748 10.1006/jmbi.1996.0897 1:CAS:528:DyaK2sXis1KntLo%3D (Pubitemid 27170693)
-
(1997)
Journal of Molecular Biology
, vol.267
, Issue.3
, pp. 727-748
-
-
Jones, G.1
Willett, P.2
Glen, R.C.3
Leach, A.R.4
Taylor, R.5
-
31
-
-
34548288600
-
Virtual screening in drug discovery - A computational perspective
-
DOI 10.2174/138920307781369427
-
AS Reddy PS Priyadarshini PP Kumar HN Pradeep GN Sastry 2007 Virtual screening in drug discovery - A computational perspective Curr Prot Pept Sci 8 329 351 10.2174/138920307781369427 1:CAS:528:DC%2BD2sXpslKrs70%3D (Pubitemid 47317040)
-
(2007)
Current Protein and Peptide Science
, vol.8
, Issue.4
, pp. 329-351
-
-
Reddy, A.S.1
Pati, S.P.2
Kumar, P.P.3
Pradeep, H.N.4
Sastry, G.N.5
-
32
-
-
0037330036
-
Crystal structure of the 1:2:2 adduct of piperazine, o-phthalic acid and water
-
10.2116/analsci.19.333 1:CAS:528:DC%2BD3sXhtlOgtb0%3D
-
ZM Jin YJ Pan L He ZG Li KB Yu 2003 Crystal structure of the 1:2:2 adduct of piperazine, o-phthalic acid and water Anal Sci 19 333 334 10.2116/analsci.19.333 1:CAS:528:DC%2BD3sXhtlOgtb0%3D
-
(2003)
Anal Sci
, vol.19
, pp. 333-334
-
-
Jin, Z.M.1
Pan, Y.J.2
He, L.3
Li, Z.G.4
Yu, K.B.5
-
35
-
-
0027968068
-
CLUSTAL W: Improving the sensitivity of progressive multiple sequence alignment through sequence weighting, position-specific gap penalties and weight matrix choice
-
JD Thompson DG Higgins TJ Gibson 1994 CLUSTAL W: improving the sensitivity of progressive multiple sequence alignment through sequence weighting, position-specific gap penalties and weight matrix choice Nucleic Acids Res 22 4673 4680 10.1093/nar/22.22.4673 1:CAS:528:DyaK2MXitlSgu74%3D (Pubitemid 24354800)
-
(1994)
Nucleic Acids Research
, vol.22
, Issue.22
, pp. 4673-4680
-
-
Thompson, J.D.1
Higgins, D.G.2
Gibson, T.J.3
-
36
-
-
0028411658
-
Molecular lipophilicity potential, a tool in 3D QSAR: Method and applications
-
10.1007/BF00119860
-
P Alessandro G Vistoli P Gaillard PA Carrupt B Testa A Boudon 1994 Molecular lipophilicity potential, a tool in 3D QSAR: method and applications J Comput Aided Mol Des 8 83 96 10.1007/BF00119860
-
(1994)
J Comput Aided Mol des
, vol.8
, pp. 83-96
-
-
Alessandro, P.1
Vistoli, G.2
Gaillard, P.3
Carrupt, P.A.4
Testa, B.5
Boudon, A.6
-
37
-
-
79958132862
-
-
Accelrys Discovery Studio v2.1.0.8130
-
Accelrys Discovery Studio v2.1.0.8130
-
-
-
|