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BDBM50006107 CHEMBL3234679

SMILES: CNC(=O)[C@@H](NC(=O)c1nc(-c2ccccc2)n2CCCN(C)Cc12)C(C)(C)C

InChI Key: InChIKey=NIHGAEUTNGSLEZ-GOSISDBHSA-N

Data: 2 EC50

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 = 50006107   
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))
BDBM50006107
PNG
(CHEMBL3234679)
Show SMILES CNC(=O)[C@@H](NC(=O)c1nc(-c2ccccc2)n2CCCN(C)Cc12)C(C)(C)C |r|
Show InChI InChI=1S/C22H31N5O2/c1-22(2,3)18(21(29)23-4)25-20(28)17-16-14-26(5)12-9-13-27(16)19(24-17)15-10-7-6-8-11-15/h6-8,10-11,18H,9,12-14H2,1-5H3,(H,23,29)(H,25,28)/t18-/m1/s1
PDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 10n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor assessed as inhibition of forskolin-induced cAMP production preincubated for 15 mins followed by forskolin cha...


Cell Chem Biol 56: 8224-56 (2013)


Article DOI: 10.1021/jm4005626
BindingDB Entry DOI: 10.7270/Q2B859M5
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50006107
PNG
(CHEMBL3234679)
Show SMILES CNC(=O)[C@@H](NC(=O)c1nc(-c2ccccc2)n2CCCN(C)Cc12)C(C)(C)C |r|
Show InChI InChI=1S/C22H31N5O2/c1-22(2,3)18(21(29)23-4)25-20(28)17-16-14-26(5)12-9-13-27(16)19(24-17)15-10-7-6-8-11-15/h6-8,10-11,18H,9,12-14H2,1-5H3,(H,23,29)(H,25,28)/t18-/m1/s1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor assessed as inhibition of forskolin-induced cAMP production preincubated for 15 mins followed by forskolin cha...


Cell Chem Biol 56: 8224-56 (2013)


Article DOI: 10.1021/jm4005626
BindingDB Entry DOI: 10.7270/Q2B859M5
More data for this
Ligand-Target Pair