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BDBM50263020 (1-(3-ethoxyphenyl)-2-(4-ethylphenyl)-1H-imidazol-4-yl)(4-(naphthalen-2-yl)piperazin-1-yl)methanone::CHEMBL476725

SMILES: CCOc1cccc(c1)-n1cc(nc1-c1ccc(CC)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1

InChI Key: InChIKey=QUPZUONIBUTKDR-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50263020   
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
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50263020
PNG
((1-(3-ethoxyphenyl)-2-(4-ethylphenyl)-1H-imidazol-...)
Show SMILES CCOc1cccc(c1)-n1cc(nc1-c1ccc(CC)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C34H34N4O2/c1-3-25-12-14-27(15-13-25)33-35-32(24-38(33)30-10-7-11-31(23-30)40-4-2)34(39)37-20-18-36(19-21-37)29-17-16-26-8-5-6-9-28(26)22-29/h5-17,22-24H,3-4,18-21H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 43n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human CCK1 receptor


Bioorg Med Chem Lett 18: 4393-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.057
BindingDB Entry DOI: 10.7270/Q2HH6JW0
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50263020
PNG
((1-(3-ethoxyphenyl)-2-(4-ethylphenyl)-1H-imidazol-...)
Show SMILES CCOc1cccc(c1)-n1cc(nc1-c1ccc(CC)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C34H34N4O2/c1-3-25-12-14-27(15-13-25)33-35-32(24-38(33)30-10-7-11-31(23-30)40-4-2)34(39)37-20-18-36(19-21-37)29-17-16-26-8-5-6-9-28(26)22-29/h5-17,22-24H,3-4,18-21H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 175n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity against human CCK1 receptor


Bioorg Med Chem Lett 18: 4393-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.057
BindingDB Entry DOI: 10.7270/Q2HH6JW0
More data for this
Ligand-Target Pair