Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50287078'   

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))	BDBM50287078 ((S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[(Z)-2-...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(=C\c1ccc(OP(O)(O)=O)cc1)\C(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O Show InChI InChI=1S/C31H41N4O18P/c1-3-15(2)25(29(45)34-21(31(48)49)10-13-24(40)41)35-28(44)20(9-12-23(38)39)33-27(43)19(8-11-22(36)37)32-26(42)18(30(46)47)14-16-4-6-17(7-5-16)53-54(50,51)52/h4-7,14-15,19-21,25H,3,8-13H2,1-2H3,(H,32,42)(H,33,43)(H,34,45)(H,35,44)(H,36,37)(H,38,39)(H,40,41)(H,46,47)(H,48,49)(H2,50,51,52)/b18-14-/t15-,19?,20?,21-,25-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to p60 src SH2 domain.				Bioorg Med Chem Lett 6: 1209-1214 (1996) Article DOI: 10.1016/0960-894X(96)00208-9 BindingDB Entry DOI: 10.7270/Q26W9B2W
					More data for this Ligand-Target Pair