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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 = 'BDBM50428490'   
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))
BDBM50428490
PNG
(CHEMBL2335190)
Show SMILES CCc1ccc2ccc(=O)oc2c1C(C)=O
Show InChI InChI=1S/C13H12O3/c1-3-9-4-5-10-6-7-11(15)16-13(10)12(9)8(2)14/h4-7H,3H2,1-2H3
PDB
MMDB

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Similars

Article
PubMed
1n/an/an/an/an/an/an/an/a



Vilnius University Institute of Biotechnology

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12


Bioorg Med Chem 21: 1431-6 (2013)


Article DOI: 10.1016/j.bmc.2012.10.016
BindingDB Entry DOI: 10.7270/Q2C24XR8
More data for this
Ligand-Target Pair