-
1
-
-
0031024171
-
Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
-
DOI 10.1016/S0169-409X(96)00423-1, PII S0169409X96004231
-
Lipinski CA, Lombardo F, Dominy BW, et al. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Adv Drug Deliv Rev 1997;23:3-25 (Pubitemid 27046991)
-
(1997)
Advanced Drug Delivery Reviews
, vol.23
, Issue.1-3
, pp. 3-25
-
-
Lipinski, C.A.1
Lombardo, F.2
Dominy, B.W.3
Feeney, P.J.4
-
2
-
-
0037376928
-
Pharmaceutical profiling in drug discovery
-
DOI 10.1016/S1359-6446(03)02649-7, PII S1359644603026497
-
Kerns EH, Di L. Pharmaceutical profiling in drug discovery. Drug Discov Today 2003;8(7):316-23 (Pubitemid 36332223)
-
(2003)
Drug Discovery Today
, vol.8
, Issue.7
, pp. 316-323
-
-
Kerns, E.H.1
Di, L.2
-
3
-
-
85047683939
-
Maximising use of in vitro ADMET tools to predict in vivo bioavailability and safety
-
DOI 10.1517/17425225.3.5.641
-
Wang J, Urban L, Bojanic D. Maximising use of in vitro ADMET tools to predict in vivo bioavailability and safety. Expert Opin Drug Metab Toxicol 2007;3(5):641-65 (Pubitemid 351320635)
-
(2007)
Expert Opinion on Drug Metabolism and Toxicology
, vol.3
, Issue.5
, pp. 641-665
-
-
Wang, J.1
Urban, L.2
Bojanic, D.3
-
4
-
-
0030886937
-
Managing the drug discovery/development interface
-
Kennedy T. Managing the drug discovery/development interface. Drug Discov Tech 1997;2:436-41
-
(1997)
Drug Discov Tech
, vol.2
, pp. 436-41
-
-
Kennedy, T.1
-
5
-
-
4344645978
-
Can the pharmaceutical industry reduce attrition rates?
-
Kola I, Landis J. Can the pharmaceutical industry reduce attrition rates? Nat Rev Drug Discov 2004;3:711-15 (Pubitemid 39173511)
-
(2004)
Nature Reviews Drug Discovery
, vol.3
, Issue.8
, pp. 711-715
-
-
Kola, I.1
Landis, J.2
-
6
-
-
69249141066
-
Comprehensive assessment of ADMET risks in drug discovery
-
Wang J. Comprehensive assessment of ADMET risks in drug discovery. Curr Pharm Des 2009;15(19):2195-219
-
(2009)
Curr Pharm des
, vol.15
, Issue.19
, pp. 2195-219
-
-
Wang, J.1
-
7
-
-
74049143211
-
ADME optimization and toxicity assessment in early-and late-phase drug discovery
-
Caldwell GW, Yan Z, Tang W, et al. ADME optimization and toxicity assessment in early-and late-phase drug discovery. Curr Top Med Chem 2009;9(11):965-80
-
(2009)
Curr Top Med Chem
, vol.9
, Issue.11
, pp. 965-80
-
-
Caldwell, G.W.1
Yan, Z.2
Tang, W.3
-
8
-
-
65549113862
-
High throughput screening of physicochemical properties and in vitro ADME profiling in drug discovery
-
Wan H, Holmen AG. High throughput screening of physicochemical properties and in vitro ADME profiling in drug discovery. Comb Chem High Throughput Screen 2009;12(3):315-29
-
(2009)
Comb Chem High Throughput Screen
, vol.12
, Issue.3
, pp. 315-29
-
-
Wan, H.1
Holmen, A.G.2
-
9
-
-
42149153187
-
Application of CYP3A4 in vitro data to predict clinical drug-drug interactions; predictions of compounds as objects of interaction
-
DOI 10.1111/j.1365-2125.2007.03070.x
-
Youdim KA, Zayed A, Dickins M, et al. Application of CYP3A4 in vitro data to predict clinical drug-drug interactions; predictions of compounds as objects of interaction. Br J Clin Pharmacol 2008;65(5):680-92 (Pubitemid 351535079)
-
(2008)
British Journal of Clinical Pharmacology
, vol.65
, Issue.5
, pp. 680-692
-
-
Youdim, K.A.1
Zayed, A.2
Dickins, M.3
Phipps, A.4
Griffiths, M.5
Darekar, A.6
Hyland, R.7
Fahmi, O.8
Hurst, S.9
Plowchalk, D.R.10
Cook, J.11
Guo, F.12
Obach, R.S.13
-
10
-
-
77949381133
-
Predictions of metabolic drug-drug interactions using physiologically based modelling: Two cytochrome P450 3A4 substrates coadministered with ketoconazole or verapamil
-
Perdaems N, Blasco H, Vinson C, et al. Predictions of metabolic drug-drug interactions using physiologically based modelling: two cytochrome P450 3A4 substrates coadministered with ketoconazole or verapamil. Clin Pharmacokinet 2010;49(4):239-58
-
(2010)
Clin Pharmacokinet
, vol.49
, Issue.4
, pp. 239-58
-
-
Perdaems, N.1
Blasco, H.2
Vinson, C.3
-
11
-
-
85018194029
-
Plasma protein binding and volume of distribution: Determination, prediction and use in early drug discovery
-
Lombardo F, Obach RS, Waters NJ. Plasma protein binding and volume of distribution: determination, prediction and use in early drug discovery. Methods Princ Med Chem 2009;43:197-220
-
(2009)
Methods Princ Med Chem
, vol.43
, pp. 197-220
-
-
Lombardo, F.1
Obach, R.S.2
Waters, N.J.3
-
12
-
-
73349092713
-
Practical anticipation of human efficacious doses and pharmacokinetics using in vitro and preclinical in vivo data
-
Heimbach T, Lakshminarayana SB, Hu W, et al. Practical anticipation of human efficacious doses and pharmacokinetics using in vitro and preclinical in vivo data. AAPS J 2009;11(3):602-14
-
(2009)
AAPS J
, vol.11
, Issue.3
, pp. 602-14
-
-
Heimbach, T.1
Lakshminarayana, S.B.2
Hu, W.3
-
13
-
-
76749105139
-
Mitigating permeability-mediated risks in drug discovery
-
Wang J, Skolnik S. Mitigating permeability-mediated risks in drug discovery. Expert Opin Drug Metab Toxicol 2010;6(2):171-87
-
(2010)
Expert Opin Drug Metab Toxicol
, vol.6
, Issue.2
, pp. 171-87
-
-
Wang, J.1
Skolnik, S.2
-
14
-
-
77954814751
-
Evolving molecules using multi-objective optimization: Applying to ADME/Tox
-
Ekins S, Honeycutt JD, Metz JT. Evolving molecules using multi-objective optimization: applying to ADME/Tox. Drug Discov Today 2010;15:451-60
-
(2010)
Drug Discov Today
, vol.15
, pp. 451-60
-
-
Ekins, S.1
Honeycutt, J.D.2
Metz, J.T.3
-
15
-
-
77953409482
-
In vitro safety pharmacology profiling: What else beyond hERG?
-
Hamon J, Whitebread S, Techer-Etienne V, et al. In vitro safety pharmacology profiling: what else beyond hERG? Future Med Chem 2009;1(4):645-65
-
(2009)
Future Med Chem
, vol.1
, Issue.4
, pp. 645-65
-
-
Hamon, J.1
Whitebread, S.2
Techer-Etienne, V.3
-
16
-
-
79851514658
-
Lead optimization in the non drug-like space
-
Zhou H. Lead optimization in the non drug-like space. Drug Discov Today 2011;16(3/4):158-63
-
(2011)
Drug Discov Today
, vol.16
, Issue.3-4
, pp. 158-63
-
-
Zhou, H.1
-
17
-
-
0034687231
-
Prediction of drug absorption using multivariate statistics
-
Egan WJ, Merz KM Jr, Baldwin JJ. Prediction of drug absorption using multivariate statistics. J Med Chem 2000;43:3867-77
-
(2000)
J Med Chem
, vol.43
, pp. 3867-77
-
-
Egan, W.J.1
Merz, Jr.K.M.2
Baldwin, J.J.3
-
18
-
-
63149182785
-
Early integration of pharmacokinetic and dynamic reasoning is essential for optimal development of lead compounds: Strategic considerations
-
Gabrielsson J, Dolgos H, ran Gillberg P-G, et al. Early integration of pharmacokinetic and dynamic reasoning is essential for optimal development of lead compounds: strategic considerations. Drug Discov Today 2009;14(7/8):358-72
-
(2009)
Drug Discov Today
, vol.14
, Issue.7-8
, pp. 358-72
-
-
Gabrielsson, J.1
Dolgos, H.2
Ran Gillberg, P.-G.3
-
19
-
-
34548493913
-
Using pharmacokinetic pharmacodynamic modelling in safety pharmacology to better define safety margins: A regional workshop of the Safety Pharmacology Society. 13 February, 2007, Pfizer, Sandwich, Kent, UK
-
DOI 10.1517/14740338.6.4.465
-
Cavero I. Using pharmacokinetic/pharmacodynamic modelling in safety pharmacology to better define safety margins: a regional workshop of the Safety Pharmacology Society. Expert Opin Drug Saf 2007;6(4):465-71 (Pubitemid 351308175)
-
(2007)
Expert Opinion on Drug Safety
, vol.6
, Issue.4
, pp. 465-471
-
-
Cavero, I.1
-
20
-
-
77953680038
-
Defining desirable central nervous system drug space through the alignment of molecular properties in vitro ADME and safety attributes
-
Wager TT, Chandrasekaran RY, Hou X, et al. Defining desirable central nervous system drug space through the alignment of molecular properties, in vitro ADME, and safety attributes. ACS Chem Neurosci 2010;1(6):420-34
-
(2010)
ACS Chem Neurosci
, vol.1
, Issue.6
, pp. 420-34
-
-
Wager, T.T.1
Chandrasekaran, R.Y.2
Hou, X.3
-
21
-
-
34748925493
-
Prediction of human pharmacokinetics using physiologically based modeling: A retrospective analysis of 26 clinically tested drugs
-
DOI 10.1124/dmd.107.015644
-
De Buck SS, Sinha VK, Fenu LA, et al. Prediction of human pharmacokinetics using physiologically based modeling: a retrospective analysis of 26 clinically tested drugs. Drug Metab Dispos 2007;35(10):1766-80 (Pubitemid 47481568)
-
(2007)
Drug Metabolism and Disposition
, vol.35
, Issue.10
, pp. 1766-1780
-
-
De Buck, S.S.1
Sinha, V.K.2
Fenu, L.A.3
Nijsen, M.J.4
Mackie, C.E.5
Gilissen, R.A.H.J.6
-
23
-
-
77649131395
-
Design and application of microfluidic systems for in vitro pharmacokinetic evaluation of drug candidates
-
Maguire TJ, Novik E, Chao P, et al. Design and application of microfluidic systems for in vitro pharmacokinetic evaluation of drug candidates. Curr Drug Metab 2009;10(10):1192-9
-
(2009)
Curr Drug Metab
, vol.10
, Issue.10
, pp. 1192-9
-
-
Maguire, T.J.1
Novik, E.2
Chao, P.3
-
24
-
-
77955785233
-
Integration of in silico and in vitro platforms for pharmacokinetic- pharmacodynamic modeling
-
Sung JH, Esch MB, Shuler ML. Integration of in silico and in vitro platforms for pharmacokinetic-pharmacodynamic modeling. Expert Opin Drug Metab Toxicol 2010;6(9):1063-81
-
(2010)
Expert Opin Drug Metab Toxicol
, vol.6
, Issue.9
, pp. 1063-81
-
-
Sung, J.H.1
Esch, M.B.2
Shuler, M.L.3
-
25
-
-
77954362516
-
Sandwich-cultured hepatocytes: An in vitro model to evaluate hepatobiliary transporter-based drug interactions and hepatotoxicity
-
Swift B, Pfeifer ND, Brouwer KLR. Sandwich-cultured hepatocytes: an in vitro model to evaluate hepatobiliary transporter-based drug interactions and hepatotoxicity. Drug Metab Rev 2010;42(3):446-71
-
(2010)
Drug Metab Rev
, vol.42
, Issue.3
, pp. 446-71
-
-
Swift, B.1
Pfeifer, N.D.2
Brouwer, K.L.R.3
-
26
-
-
33745331071
-
A simple approach for indexing the oral druglikeness of a compound: Discriminating druglike compounds from nondruglike ones
-
DOI 10.1021/ci050459i
-
Biswas D, Roy S, Sen S. A simple approach for indexing the oral druglikeness of a compound: discriminating druglike compounds from nondruglike ones. J Chem Inform Mod 2006;46(3):1394-401 (Pubitemid 43999183)
-
(2006)
Journal of Chemical Information and Modeling
, vol.46
, Issue.3
, pp. 1394-1401
-
-
Biswas, D.1
Roy, S.2
Sen, S.3
-
27
-
-
53549100467
-
Can in vitro metabolism-dependent covalent binding data in liver microsomes distinguish hepatotoxic from nonhepatotoxic drugs? An analysis of 18 drugs with consideration of intrinsic clearance and daily dose
-
Obach RS, Kalgutkar AS, Soglia JR, et al. Can in vitro metabolism-dependent covalent binding data in liver microsomes distinguish hepatotoxic from nonhepatotoxic drugs? An analysis of 18 drugs with consideration of intrinsic clearance and daily dose. Chem Res Toxicol 2008;21(9):1814-22
-
(2008)
Chem Res Toxicol
, vol.21
, Issue.9
, pp. 1814-22
-
-
Obach, R.S.1
Kalgutkar, A.S.2
Soglia, J.R.3
-
28
-
-
48949117177
-
Structure-ADME relationship: Still a long way to go?
-
DOI 10.1517/17425255.4.6.759
-
Hou T, Wang J. Structure -ADME relationship: still a long way to go? Expert Opin Drug Metab Toxicol 2008;4(6):759-70 (Pubitemid 352003198)
-
(2008)
Expert Opinion on Drug Metabolism and Toxicology
, vol.4
, Issue.6
, pp. 759-770
-
-
Hou, T.1
Wang, J.2
-
29
-
-
72449126563
-
Recent advances in physicochemical and ADMET profiling in drug discovery
-
Wang J, Skolnik S. Recent advances in physicochemical and ADMET profiling in drug discovery. Chem Biodivers 2009;6:1887-99
-
(2009)
Chem Biodivers
, vol.6
, pp. 1887-99
-
-
Wang, J.1
Skolnik, S.2
|