new BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50332895'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50332895
PNG
(1-(2,4-Difluorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1...)
Show SMILES Cc1ccc(C)n1-c1c(C)c(nn1-c1ccc(F)cc1F)C(=O)NCCC(C)(C)C |(.88,1.17,;.41,-.3,;-1.04,-.77,;-1.05,-2.3,;.42,-2.78,;.89,-4.25,;1.33,-1.55,;2.86,-1.48,;3.4,-.04,;2.57,1.26,;4.92,-.12,;5.33,-1.59,;4.06,-2.44,;4.06,-3.99,;2.73,-4.76,;2.73,-6.3,;4.06,-7.08,;4.06,-8.62,;5.4,-6.3,;5.39,-4.75,;6.74,-3.97,;5.74,1.21,;5.03,2.55,;7.29,1.15,;8.01,-.2,;9.55,-.25,;10.28,-1.61,;9.46,-2.92,;11.82,-1.67,;10.82,-3.05,)|
Show InChI InChI=1S/C23H28F2N4O/c1-14-7-8-15(2)28(14)22-16(3)20(21(30)26-12-11-23(4,5)6)27-29(22)19-10-9-17(24)13-18(19)25/h7-10,13H,11-12H2,1-6H3,(H,26,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
90.7n/an/an/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from recombinant human CB1 receptor transfected in HEK cells


Eur J Med Chem 45: 5878-86 (2010)


Article DOI: 10.1016/j.ejmech.2010.09.053
BindingDB Entry DOI: 10.7270/Q22Z15T3
More data for this
Ligand-Target Pair