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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM50476465'   
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))
BDBM50476465
PNG
(CHEMBL233898)
Show SMILES COc1ccc(cc1OCCN1CCC(C)CC1)N1Cc2cc(Cl)ccc2C1=O
Show InChI InChI=1S/C23H27ClN2O3/c1-16-7-9-25(10-8-16)11-12-29-22-14-19(4-6-21(22)28-2)26-15-17-13-18(24)3-5-20(17)23(26)27/h3-6,13-14,16H,7-12,15H2,1-2H3
PDB

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PC cid
PC sid
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Article
PubMed
25n/an/an/an/an/an/an/an/a



GlaxoSmithKline Medicine Research Centre

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from 5HT2C receptor expressed in HEK293 cells


Bioorg Med Chem Lett 17: 428-33 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.029
BindingDB Entry DOI: 10.7270/Q2TX3J4X
More data for this
Ligand-Target Pair