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BDBM50163131 1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-methyl-1H-imidazole-4-carboxylic acid tert-butoxy-amide::CHEMBL360138

SMILES: Cc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1)C(=O)NOC(C)(C)C

InChI Key: InChIKey=PNYCYGVLNOKFSQ-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50163131   
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 2


(Homo sapiens (Human))
BDBM50163131
PNG
(1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-meth...)
Show SMILES Cc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1)C(=O)NOC(C)(C)C
Show InChI InChI=1S/C21H20Cl3N3O2/c1-12-18(20(28)26-29-21(2,3)4)25-19(16-10-7-14(23)11-17(16)24)27(12)15-8-5-13(22)6-9-15/h5-11H,1-4H3,(H,26,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
242n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
In vitro displacement of CP-55940 binding to human CB2 receptor expressed in CHO cells


J Med Chem 48: 1823-38 (2005)


Article DOI: 10.1021/jm040843r
BindingDB Entry DOI: 10.7270/Q2251JX2
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50163131
PNG
(1-(4-Chloro-phenyl)-2-(2,4-dichloro-phenyl)-5-meth...)
Show SMILES Cc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1)C(=O)NOC(C)(C)C
Show InChI InChI=1S/C21H20Cl3N3O2/c1-12-18(20(28)26-29-21(2,3)4)25-19(16-10-7-14(23)11-17(16)24)27(12)15-8-5-13(22)6-9-15/h5-11H,1-4H3,(H,26,28)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
333n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
In vitro displacement of CP-55940 binding to human CB1 receptor expressed in CHO cells


J Med Chem 48: 1823-38 (2005)


Article DOI: 10.1021/jm040843r
BindingDB Entry DOI: 10.7270/Q2251JX2
More data for this
Ligand-Target Pair