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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 = 'BDBM50317393'   
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))
BDBM50317393
PNG
(5-(Aminosulfonyl)-N-(2-methoxyethyl)-2-[(2-phenyle...)
Show SMILES COCCNC(=O)c1cc(ccc1SCCc1ccccc1)S(N)(=O)=O
Show InChI InChI=1S/C18H22N2O4S2/c1-24-11-10-20-18(21)16-13-15(26(19,22)23)7-8-17(16)25-12-9-14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,20,21)(H2,19,22,23)
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 1.91E+3n/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