Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carboxypeptidase B2' and Ligand = 'BDBM50197531'   

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
Carboxypeptidase B2 (Homo sapiens (Human))	BDBM50197531 (CHEMBL3949183) Show SMILES CC12CC3CC(C)(C1)CC(C3)(C2)NC(=O)[C@H](CC1CCCCC1)NS(=O)(=O)N[C@@H](CCCCN)C(O)=O |r,TLB:10:9:7:4.3.2,THB:12:9:7:4.3.2,10:3:7:9.11.8,6:5:2:9.11.10,8:9:7.5.4:2,8:5:2:9.11.10| Show InChI InChI=1S/C27H48N4O5S/c1-25-13-20-14-26(2,16-25)18-27(15-20,17-25)29-23(32)22(12-19-8-4-3-5-9-19)31-37(35,36)30-21(24(33)34)10-6-7-11-28/h19-22,30-31H,3-18,28H2,1-2H3,(H,29,32)(H,33,34)/t20?,21-,22-,25?,26?,27?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi R&D Curated by ChEMBL					Assay Description Inhibition of activated human plasma TAFI incubated for 15 mins in presence of 1% human serum albumin by chromogenic assay				J Med Chem 59: 9567-9573 (2016) Article DOI: 10.1021/acs.jmedchem.6b01276 BindingDB Entry DOI: 10.7270/Q2MG7RG2
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