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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B' and Ligand = 'BDBM50031933'   
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)
BDBM50031933
PNG
(6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
32n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist


J Med Chem 41: 2029-39 (1998)


Article DOI: 10.1021/jm970745o
BindingDB Entry DOI: 10.7270/Q2CJ8H7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031933
PNG
(6-Piperazin-1-yl-7-oxa-5-aza-benzo[c]fluorene | CH...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c2c3ccccc3oc12
Show InChI InChI=1S/C19H17N3O/c1-3-7-15-13(5-1)17-14-6-2-4-8-16(14)23-18(17)19(21-15)22-11-9-20-10-12-22/h1-8,20H,9-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
33n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair