Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 426.4 BDBM235960

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))	BDBM235960 (US9365539, 82) Show SMILES Fc1ccc(cc1)-c1nc(C2C3CN(CCc4ccccc4)CC23)n(n1)-c1ncccn1 Show InChI InChI=1S/C25H23FN6/c26-19-9-7-18(8-10-19)23-29-24(32(30-23)25-27-12-4-13-28-25)22-20-15-31(16-21(20)22)14-11-17-5-2-1-3-6-17/h1-10,12-13,20-22H,11,14-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	28.6	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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