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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B' and Ligand = 'BDBM50047892'   
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 3A/3B


(Rattus norvegicus-RAT)
BDBM50047892
PNG
(4-Hydroxy-2-oxo-1-phenyl-1,2-dihydro-[1,8]naphthyr...)
Show SMILES CN1C2CCC1CC(C2)OC(=O)c1c(O)c2cccnc2n(-c2ccccc2)c1=O |THB:9:7:1:3.4|
Show InChI InChI=1S/C23H23N3O4/c1-25-15-9-10-16(25)13-17(12-15)30-23(29)19-20(27)18-8-5-11-24-21(18)26(22(19)28)14-6-3-2-4-7-14/h2-8,11,15-17,27H,9-10,12-13H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

PubMed
>100n/an/an/an/an/an/an/an/a



Kyowa Hakko Kogyo Company, Ltd.

Curated by ChEMBL


Assay Description
Binding affinity against radioligand [3H]quipazine labeled 5-hydroxytryptamine 3 receptor sites in neuroblastoma-glioma (NG108-15) cells.


J Med Chem 36: 617-26 (1993)


BindingDB Entry DOI: 10.7270/Q25B034N
More data for this
Ligand-Target Pair