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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 = 'BDBM50205895'   
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))
BDBM50205895
PNG
((+/-)-1,3,4,10b-tetrahydro-7-trifluoromethoxypyraz...)
Show SMILES FC(F)(F)Oc1cccc2C3CNCCN3C(=O)c12
Show InChI InChI=1S/C12H11F3N2O2/c13-12(14,15)19-9-3-1-2-7-8-6-16-4-5-17(8)11(18)10(7)9/h1-3,8,16H,4-6H2
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Article
PubMed
20n/an/an/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]DOI from human recombinant 5HT2C expressed in HEK293E cells


J Med Chem 50: 1365-79 (2007)


Article DOI: 10.1021/jm0612968
BindingDB Entry DOI: 10.7270/Q2XP74M8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50205895
PNG
((+/-)-1,3,4,10b-tetrahydro-7-trifluoromethoxypyraz...)
Show SMILES FC(F)(F)Oc1cccc2C3CNCCN3C(=O)c12
Show InChI InChI=1S/C12H11F3N2O2/c13-12(14,15)19-9-3-1-2-7-8-6-16-4-5-17(8)11(18)10(7)9/h1-3,8,16H,4-6H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 26n/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activity at human 5HT2C expressed in HEK293E cells assessed as elevation of intracellular calcium by 384-FLIPR assay


J Med Chem 50: 1365-79 (2007)


Article DOI: 10.1021/jm0612968
BindingDB Entry DOI: 10.7270/Q2XP74M8
More data for this
Ligand-Target Pair