Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 515.5 BDBM119413

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))	BDBM119413 (US8669252, 68) Show SMILES Fc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(cc1)C#N)N1CCOCC1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C31H31F2N3O2/c32-25-9-5-23(6-10-25)30(24-7-11-26(33)12-8-24)35-31(37)28-14-13-27(36-15-17-38-18-16-36)19-29(28)22-3-1-21(20-34)2-4-22/h1-12,27-30H,13-19H2,(H,35,37)/t27-,28-,29+/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	2.90	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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