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BDBM50397384 CHEMBL2170528

SMILES: CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c(c1C)-c1ccc(CC)cc1

InChI Key: InChIKey=LFOBVSANTUUHQT-UHFFFAOYSA-N

Data: 2 KI  1 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 3 hits for monomerid = 50397384   
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))
BDBM50397384
PNG
(CHEMBL2170528)
Show SMILES CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c(c1C)-c1ccc(CC)cc1
Show InChI InChI=1S/C30H40N2O2/c1-4-6-7-12-32-19-26(28(33)27(20(32)3)25-10-8-21(5-2)9-11-25)29(34)31-30-16-22-13-23(17-30)15-24(14-22)18-30/h8-11,19,22-24H,4-7,12-18H2,1-3H3,(H,31,34)
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PC cid
PC sid
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Article
PubMed
54.3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human recombinant CB2 receptor expressed in CHO cells membrane by scintillation counting


J Med Chem 55: 8948-52 (2012)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50397384
PNG
(CHEMBL2170528)
Show SMILES CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c(c1C)-c1ccc(CC)cc1
Show InChI InChI=1S/C30H40N2O2/c1-4-6-7-12-32-19-26(28(33)27(20(32)3)25-10-8-21(5-2)9-11-25)29(34)31-30-16-22-13-23(17-30)15-24(14-22)18-30/h8-11,19,22-24H,4-7,12-18H2,1-3H3,(H,31,34)
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Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human recombinant CB1 receptor expressed in CHO cells membrane by scintillation counting


J Med Chem 55: 8948-52 (2012)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50397384
PNG
(CHEMBL2170528)
Show SMILES CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c(c1C)-c1ccc(CC)cc1
Show InChI InChI=1S/C30H40N2O2/c1-4-6-7-12-32-19-26(28(33)27(20(32)3)25-10-8-21(5-2)9-11-25)29(34)31-30-16-22-13-23(17-30)15-24(14-22)18-30/h8-11,19,22-24H,4-7,12-18H2,1-3H3,(H,31,34)
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UniChem

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Article
PubMed
n/an/an/an/a 39.9n/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressed in CHO cells membrane by [35S]-GTPgammaS assay


J Med Chem 55: 8948-52 (2012)

More data for this
Ligand-Target Pair