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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM50321870'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50321870
PNG
(5-Chloro-6-methyl-2,3-dihydro-indole-1-carboxylic ...)
Show SMILES Cc1cc2N(CCc2cc1Cl)C(=O)Nc1cccnc1
Show InChI InChI=1S/C15H14ClN3O/c1-10-7-14-11(8-13(10)16)4-6-19(14)15(20)18-12-3-2-5-17-9-12/h2-3,5,7-9H,4,6H2,1H3,(H,18,20)
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Article
PubMed
10n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human 5-hydroxytryptamine 2C receptor expressed in HEK 293 cells using [3H]mesulergine as radioligand


J Med Chem 41: 1598-612 (1998)


Article DOI: 10.1021/jm970741j
BindingDB Entry DOI: 10.7270/Q2WM1H48
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50321870
PNG
(5-Chloro-6-methyl-2,3-dihydro-indole-1-carboxylic ...)
Show SMILES Cc1cc2N(CCc2cc1Cl)C(=O)Nc1cccnc1
Show InChI InChI=1S/C15H14ClN3O/c1-10-7-14-11(8-13(10)16)4-6-19(14)15(20)18-12-3-2-5-17-9-12/h2-3,5,7-9H,4,6H2,1H3,(H,18,20)
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



University of North Texas Health Science Center

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from human cloned 5HT2C receptor expressed in HEK293 cells after 90 mins by liquid scintillation counting


Bioorg Med Chem 18: 4783-92 (2011)


Article DOI: 10.1016/j.bmc.2010.05.017
BindingDB Entry DOI: 10.7270/Q2V69KJ2
More data for this
Ligand-Target Pair