Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50119570'   

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))	BDBM50119570 (CHEMBL3617731) Show SMILES SCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1 Show InChI InChI=1S/C19H21N7OS/c27-18(7-9-28)21-13-2-1-3-14(10-13)22-19-20-8-6-16(24-19)23-17-11-15(25-26-17)12-4-5-12/h1-3,6,8,10-12,28H,4-5,7,9H2,(H,21,27)(H3,20,22,23,24,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.ejmech.2021.113318 BindingDB Entry DOI: 10.7270/Q25Q5115
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50119570 (CHEMBL3617731) Show SMILES SCCC(=O)Nc1cccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)c1 Show InChI InChI=1S/C19H21N7OS/c27-18(7-9-28)21-13-2-1-3-14(10-13)22-19-20-8-6-16(24-19)23-17-11-15(25-26-17)12-4-5-12/h1-3,6,8,10-12,28H,4-5,7,9H2,(H,21,27)(H3,20,22,23,24,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Inhibition of c-Src C277S, C483S, S496S mutant (unknown origin)				ACS Med Chem Lett 6: 898-901 (2015) Article DOI: 10.1021/acsmedchemlett.5b00167 BindingDB Entry DOI: 10.7270/Q2833TTZ
					More data for this Ligand-Target Pair