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PubMed code 23159038

Compile data set for download or QSAR
Found 2 hits of 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 12


(Homo sapiens (Human))
BDBM50428489
PNG
(CHEMBL2335191)
Show SMILES CCCc1ccc2ccc(=O)oc2c1C(C)=O
Show InChI InChI=1S/C14H14O3/c1-3-4-10-5-6-11-7-8-12(16)17-14(11)13(10)9(2)15/h5-8H,3-4H2,1-2H3
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.980n/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
More data for this
Ligand-Target Pair
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

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
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
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%