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PDB code 4Z1N

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
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

  (258/258 = 100%)
(Homo sapiens (Human))
BDBM50117670
PNG
(CHEMBL3613776)
Show SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C18H20N2O5S/c1-24-16-9-13-7-8-20(11-14(13)10-17(16)25-2)18(21)12-3-5-15(6-4-12)26(19,22)23/h3-6,9-10H,7-8,11H2,1-2H3,(H2,19,22,23)
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MMDB

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Similars

Article
PubMed
5.90n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Messina

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydration assay


Eur J Med Chem 102: 223-32 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.049
BindingDB Entry DOI: 10.7270/Q29888T8
More data for this
Ligand-Target Pair

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output