Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 559.8 BDBM119409

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))	BDBM119409 (US8669252, 9) Show SMILES FC(F)(F)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H27BrClF3N2O2/c26-18-5-1-16(2-6-18)22-15-20(32-11-13-34-14-12-32)9-10-21(22)24(33)31-23(25(28,29)30)17-3-7-19(27)8-4-17/h1-8,20-23H,9-15H2,(H,31,33)/t20-,21-,22+,23?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The potency of compounds of formula I against PrCP was determined by a fluorescence intensity kinetic assay measuring the IC50 values of PrCP inhibit...				US Patent US8669252 (2014) BindingDB Entry DOI: 10.7270/Q2J9652X
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