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BDBM50190253 4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-methyl-benzenesulfonamide::CHEMBL387480

SMILES: Cc1cc(c(cc1Cl)S(=O)(=O)CC(=O)NN)S(N)(=O)=O

InChI Key: InChIKey=UQAWWVCJRQMWLB-UHFFFAOYSA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50190253   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50190253
PNG
(4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-meth...)
Show SMILES Cc1cc(c(cc1Cl)S(=O)(=O)CC(=O)NN)S(N)(=O)=O
Show InChI InChI=1S/C9H12ClN3O5S2/c1-5-2-8(20(12,17)18)7(3-6(5)10)19(15,16)4-9(14)13-11/h2-3H,4,11H2,1H3,(H,13,14)(H2,12,17,18)
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Article
PubMed
9.20n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned CA2 by CO2 hydration assay


Bioorg Med Chem Lett 16: 4846-51 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.064
BindingDB Entry DOI: 10.7270/Q2794493
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50190253
PNG
(4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-meth...)
Show SMILES Cc1cc(c(cc1Cl)S(=O)(=O)CC(=O)NN)S(N)(=O)=O
Show InChI InChI=1S/C9H12ClN3O5S2/c1-5-2-8(20(12,17)18)7(3-6(5)10)19(15,16)4-9(14)13-11/h2-3H,4,11H2,1H3,(H,13,14)(H2,12,17,18)
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Article
PubMed
1.39E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned CA12 catalytic domain by CO2 hydration assay


Bioorg Med Chem Lett 16: 4846-51 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.064
BindingDB Entry DOI: 10.7270/Q2794493
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50190253
PNG
(4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-meth...)
Show SMILES Cc1cc(c(cc1Cl)S(=O)(=O)CC(=O)NN)S(N)(=O)=O
Show InChI InChI=1S/C9H12ClN3O5S2/c1-5-2-8(20(12,17)18)7(3-6(5)10)19(15,16)4-9(14)13-11/h2-3H,4,11H2,1H3,(H,13,14)(H2,12,17,18)
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1.44E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned CA9 catalytic domain by CO2 hydration assay


Bioorg Med Chem Lett 16: 4846-51 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.064
BindingDB Entry DOI: 10.7270/Q2794493
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50190253
PNG
(4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-meth...)
Show SMILES Cc1cc(c(cc1Cl)S(=O)(=O)CC(=O)NN)S(N)(=O)=O
Show InChI InChI=1S/C9H12ClN3O5S2/c1-5-2-8(20(12,17)18)7(3-6(5)10)19(15,16)4-9(14)13-11/h2-3H,4,11H2,1H3,(H,13,14)(H2,12,17,18)
PDB
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Article
PubMed
7.70E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned CA1 by CO2 hydration assay


Bioorg Med Chem Lett 16: 4846-51 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.064
BindingDB Entry DOI: 10.7270/Q2794493
More data for this
Ligand-Target Pair