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BDBM50325581 CHEMBL1223648::N-cyclooctyl-3-pentyl-4-phenyl-4,5-dihydro-1H-pyrazole-1-carboxamide

SMILES: CCCCCC1=NN(CC1c1ccccc1)C(=O)NC1CCCCCCC1

InChI Key: InChIKey=ZZXRSBQQNVJSCT-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 = 50325581   
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))
BDBM50325581
PNG
(CHEMBL1223648 | N-cyclooctyl-3-pentyl-4-phenyl-4,5...)
Show SMILES CCCCCC1=NN(CC1c1ccccc1)C(=O)NC1CCCCCCC1 |t:5|
Show InChI InChI=1S/C23H35N3O/c1-2-3-8-17-22-21(19-13-9-7-10-14-19)18-26(25-22)23(27)24-20-15-11-5-4-6-12-16-20/h7,9-10,13-14,20-21H,2-6,8,11-12,15-18H2,1H3,(H,24,27)
PDB

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PC cid
PC sid
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Article
PubMed
11.9n/an/an/an/an/an/an/an/a



Abbott Healthcare Products BV

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 4992-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.056
BindingDB Entry DOI: 10.7270/Q27S7P0N
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50325581
PNG
(CHEMBL1223648 | N-cyclooctyl-3-pentyl-4-phenyl-4,5...)
Show SMILES CCCCCC1=NN(CC1c1ccccc1)C(=O)NC1CCCCCCC1 |t:5|
Show InChI InChI=1S/C23H35N3O/c1-2-3-8-17-22-21(19-13-9-7-10-14-19)18-26(25-22)23(27)24-20-15-11-5-4-6-12-16-20/h7,9-10,13-14,20-21H,2-6,8,11-12,15-18H2,1H3,(H,24,27)
PDB

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KEGG

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
26.6n/an/an/an/an/an/an/an/a



Abbott Healthcare Products BV

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 4992-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.056
BindingDB Entry DOI: 10.7270/Q27S7P0N
More data for this
Ligand-Target Pair