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BDBM50154627 CHEMBL3775561

SMILES: CCCCCn1cc(C(=O)NC2CCCCC2)c(=O)n2nc(nc12)N(CC=C)CC=C

InChI Key: InChIKey=FRRVFNCOFZZDMX-UHFFFAOYSA-N

Data: 2 KI

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 = 50154627   
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))
BDBM50154627
PNG
(CHEMBL3775561)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCC2)c(=O)n2nc(nc12)N(CC=C)CC=C
Show InChI InChI=1S/C23H34N6O2/c1-4-7-11-16-28-17-19(20(30)24-18-12-9-8-10-13-18)21(31)29-23(28)25-22(26-29)27(14-5-2)15-6-3/h5-6,17-18H,2-4,7-16H2,1H3,(H,24,30)
PDB

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PC cid
PC sid
UniChem

Similars

PubMed
1.35E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB2 receptor expressed in CHO cell membranes after 60 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50154627
PNG
(CHEMBL3775561)
Show SMILES CCCCCn1cc(C(=O)NC2CCCCC2)c(=O)n2nc(nc12)N(CC=C)CC=C
Show InChI InChI=1S/C23H34N6O2/c1-4-7-11-16-28-17-19(20(30)24-18-12-9-8-10-13-18)21(31)29-23(28)25-22(26-29)27(14-5-2)15-6-3/h5-6,17-18H,2-4,7-16H2,1H3,(H,24,30)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human CB1 receptor expressed in CHO cell membranes after 90 mins by scintillation counting analysis


Eur J Med Chem 113: 11-27 (2016)


BindingDB Entry DOI: 10.7270/Q21J9CPC
More data for this
Ligand-Target Pair