Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 443.9 BDBM235951

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))	BDBM235951 (US9365539, 13) Show SMILES Clc1ccc(cc1)-c1cc(nn1-c1ccncn1)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C26H26ClN5/c27-23-8-6-22(7-9-23)25-18-24(30-32(25)26-10-14-28-19-29-26)21-12-16-31(17-13-21)15-11-20-4-2-1-3-5-20/h1-10,14,18-19,21H,11-13,15-17H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	38.4	n/a	n/a	n/a	n/a	5.5	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The assay was run in a 384-well microliter plate at 37° C. with a total volume of 50 uL. Final assay concentrations were 0.13 nM human PrCP (CHO) or ...				US Patent US9365539 (2016) BindingDB Entry DOI: 10.7270/Q22B8WXK
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