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BDBM176644 US9115121, 36

SMILES: COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc2cccnc12

InChI Key: InChIKey=KJERGGOWECYESU-UHFFFAOYSA-N

Data: 1 IC50

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

Found 1 hit for monomerid = 176644   
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))
BDBM176644
PNG
(US9115121, 36)
Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc2cccnc12
Show InChI InChI=1S/C21H18FN5O/c1-28-21-26-19(17-6-2-4-15-5-3-12-23-18(15)17)25-20(27-21)24-13-11-14-7-9-16(22)10-8-14/h2-10,12H,11,13H2,1H3,(H,24,25,26,27)
PDB

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PC cid
PC sid
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US Patent
n/an/a 17n/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