Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM147246'   

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 (Mus musculus)	BDBM147246 (US9682960, EM-8799) Show SMILES Cc1c(Cl)c(ccc1N1C(=O)C(C)(C)N(CCCOc2ccc(cc2Cl)-c2ccncc2)C1=S)C#N Show InChI InChI=1S/C27H24Cl2N4O2S/c1-17-22(7-5-20(16-30)24(17)29)33-25(34)27(2,3)32(26(33)36)13-4-14-35-23-8-6-19(15-21(23)28)18-9-11-31-12-10-18/h5-12,15H,4,13-14H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	116	n/a	n/a	n/a	n/a	7.4	25
ENDORECHERCHE, INC. US Patent					Assay Description Androgen binding is measured using the hydroxylapatite (HAP) assay. In brief, the radioactive steroid [3H]R1881 solubilized in ethanol is diluted wit...				US Patent US9682960 (2017) BindingDB Entry DOI: 10.7270/Q2PZ5708
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