BindingDB logo
myBDB logout

null

SMILES: FC(F)(F)c1cc(NC(=O)N2CCCN(CC2)C(=O)c2ccc(cc2)C(F)(F)F)no1

InChI Key: InChIKey=GNLUXEUFYBODRR-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 2 hits for monomerid = 50063902   
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 1


(Homo sapiens (Human))
BDBM50063902
PNG
(CHEMBL3400938)
Show SMILES FC(F)(F)c1cc(NC(=O)N2CCCN(CC2)C(=O)c2ccc(cc2)C(F)(F)F)no1
Show InChI InChI=1S/C18H16F6N4O3/c19-17(20,21)12-4-2-11(3-5-12)15(29)27-6-1-7-28(9-8-27)16(30)25-14-10-13(31-26-14)18(22,23)24/h2-5,10H,1,6-9H2,(H,25,26,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.00E+3n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human CB1 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins


Bioorg Med Chem Lett 25: 575-80 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.033
BindingDB Entry DOI: 10.7270/Q2222WGQ
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50063902
PNG
(CHEMBL3400938)
Show SMILES FC(F)(F)c1cc(NC(=O)N2CCCN(CC2)C(=O)c2ccc(cc2)C(F)(F)F)no1
Show InChI InChI=1S/C18H16F6N4O3/c19-17(20,21)12-4-2-11(3-5-12)15(29)27-6-1-7-28(9-8-27)16(30)25-14-10-13(31-26-14)18(22,23)24/h2-5,10H,1,6-9H2,(H,25,26,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.40n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins


Bioorg Med Chem Lett 25: 575-80 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.033
BindingDB Entry DOI: 10.7270/Q2222WGQ
More data for this
Ligand-Target Pair