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BDBM50273100 CHEMBL458492::N-[(3Z)-1-Hexyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-methoxybenzohydrazide

SMILES: CCCCCCN1C(=O)C(=NNC(=O)c2ccc(OC)cc2)c2ccccc12

InChI Key: InChIKey=FNWZHCYZGLGCAJ-UHFFFAOYSA-N

Data: 2 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50273100   
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))
BDBM50273100
PNG
(CHEMBL458492 | N-[(3Z)-1-Hexyl-2-oxo-1,2-dihydro-3...)
Show SMILES CCCCCCN1C(=O)C(=NNC(=O)c2ccc(OC)cc2)c2ccccc12 |w:10.10|
Show InChI InChI=1S/C22H25N3O3/c1-3-4-5-8-15-25-19-10-7-6-9-18(19)20(22(25)27)23-24-21(26)16-11-13-17(28-2)14-12-16/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,24,26)
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PC sid
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Similars

Article
PubMed
n/an/an/an/a 143n/an/an/an/a



The University of Texas M. D. Anderson Cancer Center

Curated by ChEMBL


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


J Med Chem 51: 4932-47 (2008)


Article DOI: 10.1021/jm8002203
BindingDB Entry DOI: 10.7270/Q2X067ZQ
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50273100
PNG
(CHEMBL458492 | N-[(3Z)-1-Hexyl-2-oxo-1,2-dihydro-3...)
Show SMILES CCCCCCN1C(=O)C(=NNC(=O)c2ccc(OC)cc2)c2ccccc12 |w:10.10|
Show InChI InChI=1S/C22H25N3O3/c1-3-4-5-8-15-25-19-10-7-6-9-18(19)20(22(25)27)23-24-21(26)16-11-13-17(28-2)14-12-16/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,24,26)
PDB

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Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 852n/an/an/an/a



The University of Texas M. D. Anderson Cancer Center

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in CHO cells by [35S]GTPgammaS assay


J Med Chem 51: 4932-47 (2008)


Article DOI: 10.1021/jm8002203
BindingDB Entry DOI: 10.7270/Q2X067ZQ
More data for this
Ligand-Target Pair