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BDBM50374388 CHEMBL256268

SMILES: O=C([C@@H]1CCCN1CCCc1ccccc1)N1CCC[C@H]1C(=O)c1nc2ccccc2s1

InChI Key: InChIKey=YXDYKNZTHFDTQX-VXKWHMMOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50374388   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prolyl endopeptidase


(Sus scrofa)
BDBM50374388
PNG
(CHEMBL256268)
Show SMILES O=C([C@@H]1CCCN1CCCc1ccccc1)N1CCC[C@H]1C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C26H29N3O2S/c30-24(25-27-20-12-4-5-15-23(20)32-25)21-13-8-18-29(21)26(31)22-14-7-17-28(22)16-6-11-19-9-2-1-3-10-19/h1-5,9-10,12,15,21-22H,6-8,11,13-14,16-18H2/t21-,22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Inhibition of pig kidney PEP


Bioorg Med Chem 16: 1562-95 (2008)


Article DOI: 10.1016/j.bmc.2007.11.015
BindingDB Entry DOI: 10.7270/Q21J9BNH
More data for this
Ligand-Target Pair