Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50321963'   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50321963 (CHEMBL1173311 | N-(4-Acetamidophenyl)-2-(piperazin...) Show SMILES CC(=O)Nc1ccc(Nc2nc(nc3nc[nH]c23)N2CCNCC2)cc1 Show InChI InChI=1S/C17H20N8O/c1-11(26)21-12-2-4-13(5-3-12)22-16-14-15(20-10-19-14)23-17(24-16)25-8-6-18-7-9-25/h2-5,10,18H,6-9H2,1H3,(H,21,26)(H2,19,20,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition cSRC				Bioorg Med Chem 18: 4615-24 (2011) Article DOI: 10.1016/j.bmc.2010.05.032 BindingDB Entry DOI: 10.7270/Q26H4JCQ
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