Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM245151'   

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))	BDBM245151 (US9428460, 7) Show SMILES Cc1cc(no1)C(=O)NC[C@H]1CC[C@@H](CC1)Oc1ccnc2c(F)cccc12 |r,wU:13.17,wD:10.10,(8.62,2.31,;7.08,2.31,;6.18,3.56,;4.71,3.08,;4.71,1.54,;6.18,1.06,;3.38,3.85,;3.38,5.39,;2.05,3.08,;.71,3.85,;-.62,3.08,;-1.95,3.85,;-3.29,3.08,;-3.29,1.54,;-1.95,.77,;-.62,1.54,;-4.62,.77,;-4.62,-.77,;-3.29,-1.54,;-3.29,-3.08,;-4.62,-3.85,;-5.96,-3.08,;-7.29,-3.85,;-7.29,-5.39,;-8.62,-3.08,;-8.62,-1.54,;-7.29,-.77,;-5.96,-1.54,)| Show InChI InChI=1S/C21H22FN3O3/c1-13-11-18(25-28-13)21(26)24-12-14-5-7-15(8-6-14)27-19-9-10-23-20-16(19)3-2-4-17(20)22/h2-4,9-11,14-15H,5-8,12H2,1H3,(H,24,26)/t14-,15-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	37
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description For determining the androgen receptor-dependent transcription, a cellular assay system was used, consisting of PC-3 cells (Kaighn et al., Invest. Uro...				US Patent US9428460 (2016) BindingDB Entry DOI: 10.7270/Q25719Z7
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