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BDBM50380856 CHEMBL2018660

SMILES: CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCOCCO

InChI Key: InChIKey=FNGVLPWXPCQDOC-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50380856   
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))
BDBM50380856
PNG
(CHEMBL2018660)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCOCCO
Show InChI InChI=1S/C27H43N3O5/c1-27(2,26(34)28-14-16-35-17-15-31)29-24(32)22-18-21-12-8-3-4-9-13-23(21)30(25(22)33)19-20-10-6-5-7-11-20/h18,20,31H,3-17,19H2,1-2H3,(H,28,34)(H,29,32)
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PC cid
PC sid
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Similars

Article
PubMed
0.600n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB2 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
BindingDB Entry DOI: 10.7270/Q2NV9K85
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50380856
PNG
(CHEMBL2018660)
Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(=O)NCCOCCO
Show InChI InChI=1S/C27H43N3O5/c1-27(2,26(34)28-14-16-35-17-15-31)29-24(32)22-18-21-12-8-3-4-9-13-23(21)30(25(22)33)19-20-10-6-5-7-11-20/h18,20,31H,3-17,19H2,1-2H3,(H,28,34)(H,29,32)
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.40n/an/an/an/an/an/an/an/a



Shionogi& Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis


Bioorg Med Chem Lett 22: 2894-7 (2012)


Article DOI: 10.1016/j.bmcl.2012.02.054
BindingDB Entry DOI: 10.7270/Q2NV9K85
More data for this
Ligand-Target Pair