Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 393.9 BDBM235952

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))	BDBM235952 (US9365539, 26) Show SMILES CCn1nc(cc1C1CCN(CCc2ccccc2)CC1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H28ClN3/c1-2-28-24(18-23(26-28)20-8-10-22(25)11-9-20)21-13-16-27(17-14-21)15-12-19-6-4-3-5-7-19/h3-11,18,21H,2,12-17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31.8	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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