BindingDB logo
myBDB logout

null

SMILES: COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(OC)c(c1)S(=O)(=O)NC1CC1

InChI Key: InChIKey=WXVXEMUMZMFXJE-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 = 176601   
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))		BDBM176601
PNG
(US9115121, 12)
Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(OC)c(c1)S(=O)(=O)NC1CC1
Show InChI InChI=1S/C22H24FN5O4S/c1-31-18-10-5-15(13-19(18)33(29,30)28-17-8-9-17)20-25-21(27-22(26-20)32-2)24-12-11-14-3-6-16(23)7-4-14/h3-7,10,13,17,28H,8-9,11-12H2,1-2H3,(H,24,25,26,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 12n/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