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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 12' and Ligand = 'BDBM50112759'   
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 12


(Homo sapiens (Human))
BDBM50112759
PNG
(CHEMBL3609436)
Show SMILES C[C@@H]1OC(NS(=O)(=O)ON)C=C[C@H]1OC(C)=O |r,c:10|
Show InChI InChI=1S/C8H14N2O6S/c1-5-7(15-6(2)11)3-4-8(14-5)10-17(12,13)16-9/h3-5,7-8,10H,9H2,1-2H3/t5-,7+,8?/m0/s1
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MMDB

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Similars

Article
PubMed
24n/an/an/an/an/an/an/an/a



Institut des Biomol£cules Max Mousseron (IBMM) UMR 5247 CNRS-ENSCM-Universit£ de Montpellier

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase-12 catalytic domain by stopped-flow CO2 hydration assay


ACS Med Chem Lett 6: 819-21 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00175
BindingDB Entry DOI: 10.7270/Q2NZ89D9
More data for this
Ligand-Target Pair