Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM50063116'   

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))	BDBM50063116 (1,6,8,8,10-Pentamethyl-4-trifluoromethyl-6,7,8,9-t...) Show SMILES CC1CC(C)(C)Nc2c(C)c3n(C)c(=O)cc(c3cc12)C(F)(F)F Show InChI InChI=1S/C18H21F3N2O/c1-9-8-17(3,4)22-15-10(2)16-12(6-11(9)15)13(18(19,20)21)7-14(24)23(16)5/h6-7,9,22H,8H2,1-5H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Binding affinity for human androgen receptor in transiently-transfected COS-1 cells.				J Med Chem 41: 623-39 (1998) Article DOI: 10.1021/jm970699s BindingDB Entry DOI: 10.7270/Q2VM4CZ6
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50063116 (1,6,8,8,10-Pentamethyl-4-trifluoromethyl-6,7,8,9-t...) Show SMILES CC1CC(C)(C)Nc2c(C)c3n(C)c(=O)cc(c3cc12)C(F)(F)F Show InChI InChI=1S/C18H21F3N2O/c1-9-8-17(3,4)22-15-10(2)16-12(6-11(9)15)13(18(19,20)21)7-14(24)23(16)5/h6-7,9,22H,8H2,1-5H3	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	31	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Antagonistic activity against human androgen receptor (hAR) in co-transfected CV-1 cells.				J Med Chem 41: 623-39 (1998) Article DOI: 10.1021/jm970699s BindingDB Entry DOI: 10.7270/Q2VM4CZ6
					More data for this Ligand-Target Pair