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BDBM50262815 (1-(3-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4-(quinolin-2-yl)piperazin-1-yl)methanone::CHEMBL476739

SMILES: COc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2n1

InChI Key: InChIKey=RCGCARGWWMPPSO-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50262815   
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))
BDBM50262815
PNG
((1-(3-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4...)
Show SMILES COc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2n1
Show InChI InChI=1S/C31H29N5O2/c1-22-10-12-24(13-11-22)30-33-28(21-36(30)25-7-5-8-26(20-25)38-2)31(37)35-18-16-34(17-19-35)29-15-14-23-6-3-4-9-27(23)32-29/h3-15,20-21H,16-19H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 16n/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))
BDBM50262815
PNG
((1-(3-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4...)
Show SMILES COc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2n1
Show InChI InChI=1S/C31H29N5O2/c1-22-10-12-24(13-11-22)30-33-28(21-36(30)25-7-5-8-26(20-25)38-2)31(37)35-18-16-34(17-19-35)29-15-14-23-6-3-4-9-27(23)32-29/h3-15,20-21H,16-19H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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