BDBM50287076 (S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[3-(4-phosphonooxy-phenyl)-propionylamino]-butyrylamino}-butyrylamino)-3-methyl-pentanoylamino]-pentanedioic acid::CHEMBL280346::CHEMBL3143228

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Key: InChIKey=RTNGPEYISBMRMH-MNTLLUEFSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287076   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50287076 ((S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[3-(4-p...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O Show InChI InChI=1S/C30H43N4O16P/c1-3-16(2)26(29(44)33-21(30(45)46)11-15-25(40)41)34-28(43)20(10-14-24(38)39)32-27(42)19(9-13-23(36)37)31-22(35)12-6-17-4-7-18(8-5-17)50-51(47,48)49/h4-5,7-8,16,19-21,26H,3,6,9-15H2,1-2H3,(H,31,35)(H,32,42)(H,33,44)(H,34,43)(H,36,37)(H,38,39)(H,40,41)(H,45,46)(H2,47,48,49)/t16-,19?,20?,21-,26-/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	3.40E+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