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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 = 'BDBM50290505'   
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


(Rattus norvegicus (Rat))
BDBM50290505
PNG
(3-{2-[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-ethyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCc2ccc3n(CCN4CCC(CC4)C(=O)c4ccc(F)cc4)c(=O)sc3c2)CC1
Show InChI InChI=1S/C35H41FN4O3S/c1-43-32-7-3-2-6-30(32)39-22-19-37(20-23-39)16-4-5-26-8-13-31-33(25-26)44-35(42)40(31)24-21-38-17-14-28(15-18-38)34(41)27-9-11-29(36)12-10-27/h2-3,6-13,25,28H,4-5,14-24H2,1H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
70n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2C receptor in rat choroid plexus using [3H]-N-methyl-mesulergine


Bioorg Med Chem Lett 7: 2579-2584 (1997)


Article DOI: 10.1016/S0960-894X(97)10023-3
BindingDB Entry DOI: 10.7270/Q2QN66SR
More data for this
Ligand-Target Pair