BDBM50287069 (S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[2-(2-hydroxy-phenyl)-3-(4-phosphonooxy-phenyl)-propionylamino]-butyrylamino}-butyrylamino)-3-methyl-pentanoylamino]-pentanedioic acid::CHEMBL3143231::CHEMBL417642

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)C(Cc1ccc(OP(O)(O)=O)cc1)c1ccccc1O)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Key: InChIKey=VFVMIVSAVGJBOA-SSNZNQBJSA-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 = 50287069   

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))	BDBM50287069 ((S)-2-[(2S,3S)-2-(4-Carboxy-2-{4-carboxy-2-[2-(2-h...) 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(Cc1ccc(OP(O)(O)=O)cc1)c1ccccc1O)C(=O)N[C@@H](CCC(O)=O)C(O)=O Show InChI InChI=1S/C36H47N4O17P/c1-3-19(2)31(35(51)39-26(36(52)53)14-17-30(46)47)40-34(50)25(13-16-29(44)45)38-33(49)24(12-15-28(42)43)37-32(48)23(22-6-4-5-7-27(22)41)18-20-8-10-21(11-9-20)57-58(54,55)56/h4-11,19,23-26,31,41H,3,12-18H2,1-2H3,(H,37,48)(H,38,49)(H,39,51)(H,40,50)(H,42,43)(H,44,45)(H,46,47)(H,52,53)(H2,54,55,56)/t19-,23?,24?,25?,26-,31-/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	1.40E+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