Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 455.4 BDBM50328563

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Lysosomal Pro-X carboxypeptidase (Homo sapiens (Human))	BDBM50328563 (3-(Biphenyl-4-yl)-1-{(2S)-2-[5-(2,2,2-trifluoroeth...) Show SMILES FC(F)(F)Cc1cnc([nH]1)C(=O)[C@@H]1CCCN1C(=O)CCc1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C25H24F3N3O2/c26-25(27,28)15-20-16-29-24(30-20)23(33)21-7-4-14-31(21)22(32)13-10-17-8-11-19(12-9-17)18-5-2-1-3-6-18/h1-3,5-6,8-9,11-12,16,21H,4,7,10,13-15H2,(H,29,30)/t21-/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	4.76E+5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human PrCP by FRET				J Med Chem 53: 7251-63 (2010) Article DOI: 10.1021/jm101013m BindingDB Entry DOI: 10.7270/Q2QV3MQR
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