BindingDB logo
myBDB logout

null

SMILES: COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1cccc(OC)c1C(C)(C)O

InChI Key: InChIKey=XJOQISHBIHHUFN-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 176656   
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))
BDBM176656
PNG
(US9115121, 49)
Show SMILES COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1cccc(OC)c1C(C)(C)O
Show InChI InChI=1S/C23H26F2N4O4/c1-23(2,30)18-16(6-5-7-17(18)31-3)19-27-21(29-22(28-19)32-4)26-13-12-14-8-10-15(11-9-14)33-20(24)25/h5-11,20,30H,12-13H2,1-4H3,(H,26,27,28,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4n/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