BDBM50294135 CHEMBL563339::Trifluoro-acetate(S)-3-{(R)-3-[(4-bromo-phenyl)-hydroxy-carbamoyl]-1-carboxyaminocarbonyl-propylcarbamoyl}-1-carboxy-propyl-ammonium

SMILES: [NH3+][C@@H](CCC(=O)N[C@H](CCC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O

InChI Key: InChIKey=UAMMSMJEDFEBAR-QWHCGFSZSA-O

Data: 1 KI

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 = 50294135   

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
Glyoxalase I (Saccharomyces cerevisiae)	BDBM50294135 (CHEMBL563339 | Trifluoro-acetate(S)-3-{(R)-3-[(4-b...) Show SMILES [NH3+][C@@H](CCC(=O)N[C@H](CCC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C18H23BrN4O8/c19-10-1-3-11(4-2-10)23(31)15(25)8-6-13(17(28)21-9-16(26)27)22-14(24)7-5-12(20)18(29)30/h1-4,12-13,31H,5-9,20H2,(H,21,28)(H,22,24)(H,26,27)(H,29,30)/p+1/t12-,13+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Inhibition of yeast glyoxalase 1				J Med Chem 52: 4650-6 (2009) Article DOI: 10.1021/jm900382u BindingDB Entry DOI: 10.7270/Q2S46SWK
					More data for this Ligand-Target Pair