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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 6' and Ligand = 'BDBM50236808'   
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 6


(Homo sapiens (Human))
BDBM50236808
PNG
(CHEMBL4071816)
Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)n1cc(CN2CCN(C)CC2)c2c(Cl)cccc12
Show InChI InChI=1S/C23H28ClN3O2S/c1-17(2)18-7-9-20(10-8-18)30(28,29)27-16-19(15-26-13-11-25(3)12-14-26)23-21(24)5-4-6-22(23)27/h4-10,16-17H,11-15H2,1-3H3
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Similars

Article
PubMed
9.20n/an/an/an/an/an/an/an/a



Suven Life Sciences Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against Herpes simplex virus type 1 thymidine kinase(HSV-1 TK)


J Med Chem 60: 1843-1859 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01662
BindingDB Entry DOI: 10.7270/Q27S7R1X
More data for this
Ligand-Target Pair