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Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50143803   
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 9


(Homo sapiens (Human))
BDBM50143803
PNG
(CHEMBL3758614)
Show SMILES NS(=O)(=O)c1ccc(NCc2ccccc2O)cc1
Show InChI InChI=1S/C13H14N2O3S/c14-19(17,18)12-7-5-11(6-8-12)15-9-10-3-1-2-4-13(10)16/h1-8,15-16H,9H2,(H2,14,17,18)
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Article
PubMed
2.90n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 982-8 (2016)


Article DOI: 10.1016/j.bmc.2016.01.020
BindingDB Entry DOI: 10.7270/Q2KK9DNN
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50143803
PNG
(CHEMBL3758614)
Show SMILES NS(=O)(=O)c1ccc(NCc2ccccc2O)cc1
Show InChI InChI=1S/C13H14N2O3S/c14-19(17,18)12-7-5-11(6-8-12)15-9-10-3-1-2-4-13(10)16/h1-8,15-16H,9H2,(H2,14,17,18)
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PubMed
3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 982-8 (2016)


Article DOI: 10.1016/j.bmc.2016.01.020
BindingDB Entry DOI: 10.7270/Q2KK9DNN
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50143803
PNG
(CHEMBL3758614)
Show SMILES NS(=O)(=O)c1ccc(NCc2ccccc2O)cc1
Show InChI InChI=1S/C13H14N2O3S/c14-19(17,18)12-7-5-11(6-8-12)15-9-10-3-1-2-4-13(10)16/h1-8,15-16H,9H2,(H2,14,17,18)
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Article
PubMed
8.10n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


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


Bioorg Med Chem 24: 982-8 (2016)


Article DOI: 10.1016/j.bmc.2016.01.020
BindingDB Entry DOI: 10.7270/Q2KK9DNN
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50143803
PNG
(CHEMBL3758614)
Show SMILES NS(=O)(=O)c1ccc(NCc2ccccc2O)cc1
Show InChI InChI=1S/C13H14N2O3S/c14-19(17,18)12-7-5-11(6-8-12)15-9-10-3-1-2-4-13(10)16/h1-8,15-16H,9H2,(H2,14,17,18)
PDB
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NCI pathway
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KEGG

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CHEMBL
PC cid
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UniChem

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Article
PubMed
49n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 982-8 (2016)


Article DOI: 10.1016/j.bmc.2016.01.020
BindingDB Entry DOI: 10.7270/Q2KK9DNN
More data for this
Ligand-Target Pair