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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50125190'   
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))
BDBM50125190
PNG
(CHEMBL268809 | Quinoline-8-sulfonic acid amide | q...)
Show SMILES NS(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C9H8N2O2S/c10-14(12,13)8-5-1-3-7-4-2-6-11-9(7)8/h1-6H,(H2,10,12,13)
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Article
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32n/an/an/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CA9 by stopped flow CO2 hydration assay


Bioorg Med Chem 17: 553-7 (2009)


Article DOI: 10.1016/j.bmc.2008.11.071
BindingDB Entry DOI: 10.7270/Q28K790B
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50125190
PNG
(CHEMBL268809 | Quinoline-8-sulfonic acid amide | q...)
Show SMILES NS(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C9H8N2O2S/c10-14(12,13)8-5-1-3-7-4-2-6-11-9(7)8/h1-6H,(H2,10,12,13)
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KEGG

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CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

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Article
PubMed
32n/an/an/an/an/an/an/an/a



Laxmi Fumigation and Pest Control (P)

Curated by ChEMBL


Assay Description
Inhibitory activity against human tumor-associated transmembrane carbonic anhydrase IX.


Bioorg Med Chem Lett 14: 3283-90 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.099
BindingDB Entry DOI: 10.7270/Q2K074TZ
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50125190
PNG
(CHEMBL268809 | Quinoline-8-sulfonic acid amide | q...)
Show SMILES NS(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C9H8N2O2S/c10-14(12,13)8-5-1-3-7-4-2-6-11-9(7)8/h1-6H,(H2,10,12,13)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents

PubMed
32n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory activity against human cloned carbonic anhydrase isozyme IX, by CO2 hydrase assay method.


Bioorg Med Chem Lett 13: 1005-9 (2003)


BindingDB Entry DOI: 10.7270/Q2PV6KXV
More data for this
Ligand-Target Pair