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BDBM50216187 CHEMBL232777::N-(3-chlorophenethyl)-4-(benzyloxy)-N-(pyrrolidin-3-yl)benzamide

SMILES: Clc1cccc(CCN(C2CCNC2)C(=O)c2ccc(OCc3ccccc3)cc2)c1

InChI Key: InChIKey=DSMOSSPRJOLACS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50216187   
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
Membrane-bound transcription factor site-1 protease


(Homo sapiens (Human))
BDBM50216187
PNG
(CHEMBL232777 | N-(3-chlorophenethyl)-4-(benzyloxy)...)
Show SMILES Clc1cccc(CCN(C2CCNC2)C(=O)c2ccc(OCc3ccccc3)cc2)c1 |w:9.8|
Show InChI InChI=1S/C26H27ClN2O2/c27-23-8-4-7-20(17-23)14-16-29(24-13-15-28-18-24)26(30)22-9-11-25(12-10-22)31-19-21-5-2-1-3-6-21/h1-12,17,24,28H,13-16,18-19H2
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Article
PubMed
n/an/a 510n/an/an/an/an/an/a



Pfizer Global Research and Development-Groton Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human S1P expressed in CHOK1 cells


Bioorg Med Chem Lett 17: 4411-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.031
BindingDB Entry DOI: 10.7270/Q26M36JG
More data for this
Ligand-Target Pair