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BDBM50243962 2-(4-cyclobutoxybenzyl)-N,N-diethyl-1-isopentyl-1H-benzo[d]imidazole-5-carboxamide::CHEMBL453847

SMILES: CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Cc3ccc(OC4CCC4)cc3)nc2c1

InChI Key: InChIKey=OCQRTISEANCLQE-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 = 50243962   
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))
BDBM50243962
PNG
(2-(4-cyclobutoxybenzyl)-N,N-diethyl-1-isopentyl-1H...)
Show SMILES CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Cc3ccc(OC4CCC4)cc3)nc2c1
Show InChI InChI=1S/C28H37N3O2/c1-5-30(6-2)28(32)22-12-15-26-25(19-22)29-27(31(26)17-16-20(3)4)18-21-10-13-24(14-11-21)33-23-8-7-9-23/h10-15,19-20,23H,5-9,16-18H2,1-4H3
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PC cid
PC sid
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Similars

Article
PubMed
44n/an/an/an/an/an/an/an/a



AstraZeneca R&D Montréal

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor


Bioorg Med Chem Lett 18: 3695-700 (2008)

More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (human))
BDBM50243962
PNG
(2-(4-cyclobutoxybenzyl)-N,N-diethyl-1-isopentyl-1H...)
Show SMILES CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Cc3ccc(OC4CCC4)cc3)nc2c1
Show InChI InChI=1S/C28H37N3O2/c1-5-30(6-2)28(32)22-12-15-26-25(19-22)29-27(31(26)17-16-20(3)4)18-21-10-13-24(14-11-21)33-23-8-7-9-23/h10-15,19-20,23H,5-9,16-18H2,1-4H3
PDB

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PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



AstraZeneca R&D Montréal

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor


Bioorg Med Chem Lett 18: 3695-700 (2008)

More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (human))
BDBM50243962
PNG
(2-(4-cyclobutoxybenzyl)-N,N-diethyl-1-isopentyl-1H...)
Show SMILES CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Cc3ccc(OC4CCC4)cc3)nc2c1
Show InChI InChI=1S/C28H37N3O2/c1-5-30(6-2)28(32)22-12-15-26-25(19-22)29-27(31(26)17-16-20(3)4)18-21-10-13-24(14-11-21)33-23-8-7-9-23/h10-15,19-20,23H,5-9,16-18H2,1-4H3
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PubMed
n/an/an/an/a 24n/an/an/an/a



AstraZeneca R&D Montréal

Curated by ChEMBL


Assay Description
Agonist activity at cloned human CB2 receptor in Sf9 cells assessed as stimulation of [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 18: 3695-700 (2008)

More data for this
Ligand-Target Pair