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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 4' and Ligand = 'BDBM50317390'   
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
Carbonic anhydrase 4


(Homo sapiens (Human))		BDBM50317390
PNG
(5-(Aminosulfonyl)-2-{[2-(hydroxymethyl)phenyl]thio...)
Show SMILES NS(=O)(=O)c1ccc(Sc2ccccc2CO)c(c1)C(=O)NCc1ccccn1
Show InChI InChI=1S/C20H19N3O4S2/c21-29(26,27)16-8-9-19(28-18-7-2-1-5-14(18)13-24)17(11-16)20(25)23-12-15-6-3-4-10-22-15/h1-11,24H,12-13H2,(H,23,25)(H2,21,26,27)
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MMDB

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Similars
Article
PubMed
n/an/a 952n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of carbonic anhydrase 4

Bioorg Med Chem 18: 3307-19 (2010)


Article DOI: 10.1016/j.bmc.2010.03.014
BindingDB Entry DOI: 10.7270/Q2SQ91B9
More data for this
Ligand-Target Pair