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BDBM50303842 CHEMBL567532::N-[7-(1,2,3,4-Tetrahydroacridin-9-ylamino)heptyl]-2-(2-chlorophenyl)-1-(4-chlorophenyl)-5-ethyl-1H-imidazole-4-carboxamide

SMILES: CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12

InChI Key: InChIKey=IBNHPFJFQUFNTI-UHFFFAOYSA-N

Data: 2 KI

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

Found 2 hits for monomerid = 50303842   
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
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50303842
PNG
(CHEMBL567532 | N-[7-(1,2,3,4-Tetrahydroacridin-9-y...)
Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C38H41Cl2N5O/c1-2-34-36(44-37(28-14-6-9-17-31(28)40)45(34)27-22-20-26(39)21-23-27)38(46)42-25-13-5-3-4-12-24-41-35-29-15-7-10-18-32(29)43-33-19-11-8-16-30(33)35/h6-7,9-10,14-15,17-18,20-23H,2-5,8,11-13,16,19,24-25H2,1H3,(H,41,43)(H,42,46)
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Article
PubMed
88n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells


J Med Chem 53: 1338-46 (2010)


Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50303842
PNG
(CHEMBL567532 | N-[7-(1,2,3,4-Tetrahydroacridin-9-y...)
Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C38H41Cl2N5O/c1-2-34-36(44-37(28-14-6-9-17-31(28)40)45(34)27-22-20-26(39)21-23-27)38(46)42-25-13-5-3-4-12-24-41-35-29-15-7-10-18-32(29)43-33-19-11-8-16-30(33)35/h6-7,9-10,14-15,17-18,20-23H,2-5,8,11-13,16,19,24-25H2,1H3,(H,41,43)(H,42,46)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells


J Med Chem 53: 1338-46 (2010)


Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT
More data for this
Ligand-Target Pair