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BDBM50312585 CHEMBL1087250::N-cyclohexyl-4-[(2,6-dichlorophenyl)(phenyl)methyl]piperazine-1-carboxamide

SMILES: Clc1cccc(Cl)c1C(N1CCN(CC1)C(=O)NC1CCCCC1)c1ccccc1

InChI Key: InChIKey=FXIHNXHABMIRJH-UHFFFAOYSA-N

Data: 2 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50312585   
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))
BDBM50312585
PNG
(CHEMBL1087250 | N-cyclohexyl-4-[(2,6-dichloropheny...)
Show SMILES Clc1cccc(Cl)c1C(N1CCN(CC1)C(=O)NC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C24H29Cl2N3O/c25-20-12-7-13-21(26)22(20)23(18-8-3-1-4-9-18)28-14-16-29(17-15-28)24(30)27-19-10-5-2-6-11-19/h1,3-4,7-9,12-13,19,23H,2,5-6,10-11,14-17H2,(H,27,30)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.20n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant cannabinoid CB1 receptor expressed in CHO cells after 3 hrs by liquid scintillation counting


Eur J Med Chem 45: 1133-9 (2010)


Article DOI: 10.1016/j.ejmech.2009.12.018
BindingDB Entry DOI: 10.7270/Q2K937P0
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50312585
PNG
(CHEMBL1087250 | N-cyclohexyl-4-[(2,6-dichloropheny...)
Show SMILES Clc1cccc(Cl)c1C(N1CCN(CC1)C(=O)NC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C24H29Cl2N3O/c25-20-12-7-13-21(26)22(20)23(18-8-3-1-4-9-18)28-14-16-29(17-15-28)24(30)27-19-10-5-2-6-11-19/h1,3-4,7-9,12-13,19,23H,2,5-6,10-11,14-17H2,(H,27,30)
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PC sid
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Article
PubMed
831n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant cannabinoid CB2 receptor expressed in CHO cells after 3 hrs by liquid scintillation counting


Eur J Med Chem 45: 1133-9 (2010)


Article DOI: 10.1016/j.ejmech.2009.12.018
BindingDB Entry DOI: 10.7270/Q2K937P0
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312585
PNG
(CHEMBL1087250 | N-cyclohexyl-4-[(2,6-dichloropheny...)
Show SMILES Clc1cccc(Cl)c1C(N1CCN(CC1)C(=O)NC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C24H29Cl2N3O/c25-20-12-7-13-21(26)22(20)23(18-8-3-1-4-9-18)28-14-16-29(17-15-28)24(30)27-19-10-5-2-6-11-19/h1,3-4,7-9,12-13,19,23H,2,5-6,10-11,14-17H2,(H,27,30)
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PC cid
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Article
PubMed
n/an/a 55n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Antagonist activity at human cannabinoid CB1 receptor expressed in CHO cells coexpressing Galpha15/16 assessed as inhibition of CP55940-induced Ca2+ ...


Eur J Med Chem 45: 1133-9 (2010)


Article DOI: 10.1016/j.ejmech.2009.12.018
BindingDB Entry DOI: 10.7270/Q2K937P0
More data for this
Ligand-Target Pair