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BDBM50310011 (4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-bromophenyl)-1-(2-chlorophenyl)-1H-pyrazol-3-yl)(4-methylpiperazin-1-yl)methanone::CHEMBL597482

SMILES: CN1CCN(CC1)C(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Br)cc1)-c1ccccc1Cl

InChI Key: InChIKey=QDFRDIVRWMYVNH-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50310011   
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


(Rattus norvegicus (rat))
BDBM50310011
PNG
((4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-bromopheny...)
Show SMILES CN1CCN(CC1)C(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Br)cc1)-c1ccccc1Cl
Show InChI InChI=1S/C24H23BrClN7O/c1-30-10-12-31(13-11-30)24(34)22-19(14-32-16-27-15-28-32)23(17-6-8-18(25)9-7-17)33(29-22)21-5-3-2-4-20(21)26/h2-9,15-16H,10-14H2,1H3
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 901n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane


Bioorg Med Chem 18: 1149-62 (2010)


Article DOI: 10.1016/j.bmc.2009.12.040
BindingDB Entry DOI: 10.7270/Q2TD9XG2
More data for this
Ligand-Target Pair