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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50019392'   
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))
BDBM50019392
PNG
(CHEMBL3290053)
Show SMILES [H][C@@]12CC(=CC[C@@]1([H])C(C)(C)Oc1cc(cc(OC(C)=O)c21)C(C)(C)CCCCCC)C(O)=O |r,c:3|
Show InChI InChI=1S/C27H38O5/c1-7-8-9-10-13-26(3,4)19-15-22(31-17(2)28)24-20-14-18(25(29)30)11-12-21(20)27(5,6)32-23(24)16-19/h11,15-16,20-21H,7-10,12-14H2,1-6H3,(H,29,30)/t20-,21-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
628n/an/an/an/an/an/an/an/a



Corbus Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor expressed in HEK293T cell membranes by scintillation counting


Bioorg Med Chem 22: 3245-51 (2014)


Article DOI: 10.1016/j.bmc.2014.04.062
BindingDB Entry DOI: 10.7270/Q22Z173H
More data for this
Ligand-Target Pair