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Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50037237   
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 2


(Homo sapiens (Human))
BDBM50037237
PNG
(CHEMBL3356265)
Show SMILES NS(=O)(=O)c1ccc2nc(sc2c1)-n1cc(C(O)=O)c(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H11FN4O4S2/c18-10-3-1-9(2-4-10)15-12(16(23)24)8-22(21-15)17-20-13-6-5-11(28(19,25)26)7-14(13)27-17/h1-8H,(H,23,24)(H2,19,25,26)
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Article
PubMed
2.5n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydrase assay method


Bioorg Med Chem 22: 6945-52 (2014)


Article DOI: 10.1016/j.bmc.2014.10.018
BindingDB Entry DOI: 10.7270/Q20V8FCK
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50037237
PNG
(CHEMBL3356265)
Show SMILES NS(=O)(=O)c1ccc2nc(sc2c1)-n1cc(C(O)=O)c(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H11FN4O4S2/c18-10-3-1-9(2-4-10)15-12(16(23)24)8-22(21-15)17-20-13-6-5-11(28(19,25)26)7-14(13)27-17/h1-8H,(H,23,24)(H2,19,25,26)
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Article
PubMed
30n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 by stopped flow CO2 hydrase assay method


Bioorg Med Chem 22: 6945-52 (2014)


Article DOI: 10.1016/j.bmc.2014.10.018
BindingDB Entry DOI: 10.7270/Q20V8FCK
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50037237
PNG
(CHEMBL3356265)
Show SMILES NS(=O)(=O)c1ccc2nc(sc2c1)-n1cc(C(O)=O)c(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H11FN4O4S2/c18-10-3-1-9(2-4-10)15-12(16(23)24)8-22(21-15)17-20-13-6-5-11(28(19,25)26)7-14(13)27-17/h1-8H,(H,23,24)(H2,19,25,26)
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Article
PubMed
62n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 by stopped flow CO2 hydrase assay method


Bioorg Med Chem 22: 6945-52 (2014)


Article DOI: 10.1016/j.bmc.2014.10.018
BindingDB Entry DOI: 10.7270/Q20V8FCK
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50037237
PNG
(CHEMBL3356265)
Show SMILES NS(=O)(=O)c1ccc2nc(sc2c1)-n1cc(C(O)=O)c(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H11FN4O4S2/c18-10-3-1-9(2-4-10)15-12(16(23)24)8-22(21-15)17-20-13-6-5-11(28(19,25)26)7-14(13)27-17/h1-8H,(H,23,24)(H2,19,25,26)
PDB
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Article
PubMed
313n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydrase assay method


Bioorg Med Chem 22: 6945-52 (2014)


Article DOI: 10.1016/j.bmc.2014.10.018
BindingDB Entry DOI: 10.7270/Q20V8FCK
More data for this
Ligand-Target Pair