Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM50197371'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Androgen receptor (Homo sapiens (Human))	BDBM50197371 (17beta-Hydroxy-7a-{5-(4,4,5,5,5-pentafluoropentyls...) Show SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)[C@H](CCCCCS(=O)CCCC(F)(F)C(F)(F)F)CC1CC(=O)CC[C@]31C Show InChI InChI=1S/C29H45F5O3S/c1-26-13-10-21(35)18-20(26)17-19(25-22-8-9-24(36)27(22,2)14-11-23(25)26)7-4-3-5-15-38(37)16-6-12-28(30,31)29(32,33)34/h19-20,22-25,36H,3-18H2,1-2H3/t19-,20?,22+,23+,24+,25+,26+,27+,38?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Displacement of [3H]mibolerone from androgen receptor expressed in CHOK1 cells				Bioorg Med Chem 15: 174-85 (2006) Article DOI: 10.1016/j.bmc.2006.09.072 BindingDB Entry DOI: 10.7270/Q2PC336P
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50197371 (17beta-Hydroxy-7a-{5-(4,4,5,5,5-pentafluoropentyls...) Show SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)[C@H](CCCCCS(=O)CCCC(F)(F)C(F)(F)F)CC1CC(=O)CC[C@]31C Show InChI InChI=1S/C29H45F5O3S/c1-26-13-10-21(35)18-20(26)17-19(25-22-8-9-24(36)27(22,2)14-11-23(25)26)7-4-3-5-15-38(37)16-6-12-28(30,31)29(32,33)34/h19-20,22-25,36H,3-18H2,1-2H3/t19-,20?,22+,23+,24+,25+,26+,27+,38?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Antagonist activity at androgen receptor expressed in HeLa cells assessed as inhibition of dihydrotestosterone-induced transcriptional activity by re...				Bioorg Med Chem 15: 174-85 (2006) Article DOI: 10.1016/j.bmc.2006.09.072 BindingDB Entry DOI: 10.7270/Q2PC336P
					More data for this Ligand-Target Pair