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BDBM176661 US9115121, 54

SMILES: COc1nc(NCCc2ccc(OC(F)(F)F)cc2)nc(n1)-c1ccc(OC)c(c1)C(C)(C)O

InChI Key: InChIKey=UVMYUQCRHXVGBG-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 176661   
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))
BDBM176661
PNG
(US9115121, 54)
Show SMILES COc1nc(NCCc2ccc(OC(F)(F)F)cc2)nc(n1)-c1ccc(OC)c(c1)C(C)(C)O
Show InChI InChI=1S/C23H25F3N4O4/c1-22(2,31)17-13-15(7-10-18(17)32-3)19-28-20(30-21(29-19)33-4)27-12-11-14-5-8-16(9-6-14)34-23(24,25)26/h5-10,13,31H,11-12H2,1-4H3,(H,27,28,29,30)
PDB

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US Patent
n/an/a 9n/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