Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50287077'   

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))	BDBM50287077 ((S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[3-(2,6...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1c(C)cc(OP(O)(O)=O)cc1C)C(=O)N[C@@H](CCC(O)=O)C(O)=O Show InChI InChI=1S/C32H47N4O16P/c1-5-16(2)28(31(46)35-23(32(47)48)9-13-27(42)43)36-30(45)22(8-12-26(40)41)34-29(44)21(7-11-25(38)39)33-24(37)10-6-20-17(3)14-19(15-18(20)4)52-53(49,50)51/h14-16,21-23,28H,5-13H2,1-4H3,(H,33,37)(H,34,44)(H,35,46)(H,36,45)(H,38,39)(H,40,41)(H,42,43)(H,47,48)(H2,49,50,51)/t16-,21?,22?,23-,28-/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	4.50E+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