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BDBM50163114 5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-1H-[1,2,4]triazole-3-carboxylic acid piperidin-1-ylamide; dihydrochloride::CHEMBL558564

SMILES: Clc1ccc(cc1)-c1nc(nn1-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1

InChI Key: InChIKey=LBEDYTCPCKWPRN-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 = 50163114   
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))
BDBM50163114
PNG
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-1H-[1,...)
Show SMILES Clc1ccc(cc1)-c1nc(nn1-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C20H18Cl3N5O/c21-14-6-4-13(5-7-14)19-24-18(20(29)26-27-10-2-1-3-11-27)25-28(19)17-9-8-15(22)12-16(17)23/h4-9,12H,1-3,10-11H2,(H,26,29)
PDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
382n/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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50163114
PNG
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-1H-[1,...)
Show SMILES Clc1ccc(cc1)-c1nc(nn1-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
Show InChI InChI=1S/C20H18Cl3N5O/c21-14-6-4-13(5-7-14)19-24-18(20(29)26-27-10-2-1-3-11-27)25-28(19)17-9-8-15(22)12-16(17)23/h4-9,12H,1-3,10-11H2,(H,26,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.44E+3n/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