Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50414001'   

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))	BDBM50414001 (CHEMBL511320) Show SMILES COc1cccc(c1)-c1cn(-c2ccc(CC(O)=O)cc2)c2ncnc(N)c12 Show InChI InChI=1S/C21H18N4O3/c1-28-16-4-2-3-14(10-16)17-11-25(21-19(17)20(22)23-12-24-21)15-7-5-13(6-8-15)9-18(26)27/h2-8,10-12H,9H2,1H3,(H,26,27)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of c-Src kinase (unknown origin)				Citation and Details Article DOI: 10.1007/s00044-012-0308-3 BindingDB Entry DOI: 10.7270/Q2BZ68ZH
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50414001 (CHEMBL511320) Show SMILES COc1cccc(c1)-c1cn(-c2ccc(CC(O)=O)cc2)c2ncnc(N)c12 Show InChI InChI=1S/C21H18N4O3/c1-28-16-4-2-3-14(10-16)17-11-25(21-19(17)20(22)23-12-24-21)15-7-5-13(6-8-15)9-18(26)27/h2-8,10-12H,9H2,1H3,(H,26,27)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50.1	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of c-Src				Eur J Med Chem 44: 990-1000 (2009) Article DOI: 10.1016/j.ejmech.2008.07.002 BindingDB Entry DOI: 10.7270/Q2ZC8434
					More data for this Ligand-Target Pair