BDBM50089700 CHEMBL3577325

SMILES: C[C@H](NC(=O)[C@@H](CC1CCCCC1)NC(=O)N[C@@H](CCCCN)C(O)=O)C1CCCCC1

InChI Key: InChIKey=AFPITHMSIWIQKS-DZFGPLHGSA-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 = 50089700   

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
Carboxypeptidase B2 isoform A (Homo sapiens (Human))	BDBM50089700 (CHEMBL3577325) Show SMILES C[C@H](NC(=O)[C@@H](CC1CCCCC1)NC(=O)N[C@@H](CCCCN)C(O)=O)C1CCCCC1 |r| Show InChI InChI=1S/C24H44N4O4/c1-17(19-12-6-3-7-13-19)26-22(29)21(16-18-10-4-2-5-11-18)28-24(32)27-20(23(30)31)14-8-9-15-25/h17-21H,2-16,25H2,1H3,(H,26,29)(H,30,31)(H2,27,28,32)/t17-,20-,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Infection Research Curated by ChEMBL					Assay Description Inhibition of human activated TAFI incubated for 15 mins by microtiter plate reader based assay				J Med Chem 58: 4839-44 (2015) Article DOI: 10.1021/jm501840b BindingDB Entry DOI: 10.7270/Q24B3314
					More data for this Ligand-Target Pair