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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50354400'   
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 2


(Homo sapiens (Human))
BDBM50354400
PNG
(CHEMBL1836403)
Show SMILES NS(=O)(=O)c1ccc(cc1)C#Cc1cccc(F)c1
Show InChI InChI=1S/C14H10FNO2S/c15-13-3-1-2-12(10-13)5-4-11-6-8-14(9-7-11)19(16,17)18/h1-3,6-10H,(H2,16,17,18)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
57n/an/an/an/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2-catalyzed CO2 hydration activity by stopped flow assay


Bioorg Med Chem Lett 21: 5892-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.090
BindingDB Entry DOI: 10.7270/Q2Z60PFG
More data for this
Ligand-Target Pair