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BDBM176620 US9115121, 11

SMILES: COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc(c1)S(=O)(=O)NC1CC1

InChI Key: InChIKey=FQLAVWUZUZRUGO-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   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 = 176620   
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))
BDBM176620
PNG
(US9115121, 11)
Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc(c1)S(=O)(=O)NC1CC1
Show InChI InChI=1S/C21H22FN5O3S/c1-30-21-25-19(15-3-2-4-18(13-15)31(28,29)27-17-9-10-17)24-20(26-21)23-12-11-14-5-7-16(22)8-6-14/h2-8,13,17,27H,9-12H2,1H3,(H,23,24,25,26)
PDB

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Similars

US Patent
n/an/a 2.70n/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