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BDBM176610 US9115121, 69

SMILES: COc1nc(NCCc2ccc(OCF)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O

InChI Key: InChIKey=SCBDVIYMTKNTMB-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 176610   
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))
BDBM176610
PNG
(US9115121, 69)
Show SMILES COc1nc(NCCc2ccc(OCF)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O
Show InChI InChI=1S/C22H24ClFN4O3/c1-22(2,29)17-12-15(6-9-18(17)23)19-26-20(28-21(27-19)30-3)25-11-10-14-4-7-16(8-5-14)31-13-24/h4-9,12,29H,10-11,13H2,1-3H3,(H,25,26,27,28)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 3.90n/an/an/an/an/an/a



Sanofi

US Patent


Assay Description
Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...


US Patent US9115121 (2015)


BindingDB Entry DOI: 10.7270/Q23N225X
More data for this
Ligand-Target Pair