Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM50459869'   

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))	BDBM50459869 (CHEMBL4227715) Show SMILES Cc1nn(c(C)c1Cc1ccc(cc1)C(O)=O)-c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C21H16F3N3O2/c1-12-18(9-14-3-5-15(6-4-14)20(28)29)13(2)27(26-12)17-8-7-16(11-25)19(10-17)21(22,23)24/h3-8,10H,9H2,1-2H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Health Sciences Curated by ChEMBL					Assay Description Binding affinity to androgen receptor (unknown origin)				J Med Chem 61: 543-575 (2018) Article DOI: 10.1021/acs.jmedchem.7b00168 BindingDB Entry DOI: 10.7270/Q2VT1VR7
					More data for this Ligand-Target Pair