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BDBM50262970 (1-(3-isopropoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)(4-(naphthalen-2-yl)piperazin-1-yl)methanone::CHEMBL478397

SMILES: CC(C)Oc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1

InChI Key: InChIKey=BXYVSADCGZSZPK-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 = 50262970   
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))
BDBM50262970
PNG
((1-(3-isopropoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl...)
Show SMILES CC(C)Oc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C34H34N4O2/c1-24(2)40-31-10-6-9-30(22-31)38-23-32(35-33(38)27-13-11-25(3)12-14-27)34(39)37-19-17-36(18-20-37)29-16-15-26-7-4-5-8-28(26)21-29/h4-16,21-24H,17-20H2,1-3H3
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/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))
BDBM50262970
PNG
((1-(3-isopropoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl...)
Show SMILES CC(C)Oc1cccc(c1)-n1cc(nc1-c1ccc(C)cc1)C(=O)N1CCN(CC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C34H34N4O2/c1-24(2)40-31-10-6-9-30(22-31)38-23-32(35-33(38)27-13-11-25(3)12-14-27)34(39)37-19-17-36(18-20-37)29-16-15-26-7-4-5-8-28(26)21-29/h4-16,21-24H,17-20H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 53n/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