Found 147 hits with Last Name = 'kornicka' and Initial = 'a' Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM10881
(CHEMBL288100 | MZA3 | Methazolamide | Methazolamid...)Show InChI InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM10890
(1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonam...)Show SMILES NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12 Show InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9) | PDB MMDB
Reactome pathway KEGG
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| PDB Article PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM10882
(6-ethoxy-1,3-benzothiazole-2-sulfonamide | CHEMBL1...)Show InChI InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (docked) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (docked) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50190253
(4-chloro-2-hydrazinocarbonylmethanesulfonyl-5-meth...)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 MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 9.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190247
((5-chloro-4-methyl-2-sulfamoyl-benzenesulfonyl)-ac...)Show InChI InChI=1S/C10H12ClNO6S2/c1-6-3-9(20(12,16)17)8(4-7(6)11)19(14,15)5-10(13)18-2/h3-4H,5H2,1-2H3,(H2,12,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 9.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9) | PDB MMDB
Reactome pathway KEGG
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| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM10881
(CHEMBL288100 | MZA3 | Methazolamide | Methazolamid...)Show InChI InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| PDB Article PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50190248
(4-chloro-2-mercapto-5-(pyrrolidine-1-carbonyl)benz...)Show InChI InChI=1S/C11H13ClN2O3S2/c12-8-6-9(18)10(19(13,16)17)5-7(8)11(15)14-3-1-2-4-14/h5-6,18H,1-4H2,(H2,13,16,17) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 14.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM10890
(1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonam...)Show SMILES NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12 Show InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190250
(2-chloro-4-mercapto-5-sulfamoyl-benzoic acid ethyl...)Show InChI InChI=1S/C9H10ClNO4S2/c1-2-15-9(12)5-3-8(17(11,13)14)7(16)4-6(5)10/h3-4,16H,2H2,1H3,(H2,11,13,14) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 18.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190248
(4-chloro-2-mercapto-5-(pyrrolidine-1-carbonyl)benz...)Show InChI InChI=1S/C11H13ClN2O3S2/c12-8-6-9(18)10(19(13,16)17)5-7(8)11(15)14-3-1-2-4-14/h5-6,18H,1-4H2,(H2,13,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 19.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190252
(5-(aminosulfonyl)-N-benzyl-2-chloro-4-mercaptobenz...)Show InChI InChI=1S/C14H13ClN2O3S2/c15-11-7-12(21)13(22(16,19)20)6-10(11)14(18)17-8-9-4-2-1-3-5-9/h1-7,21H,8H2,(H,17,18)(H2,16,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 19.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50190248
(4-chloro-2-mercapto-5-(pyrrolidine-1-carbonyl)benz...)Show InChI InChI=1S/C11H13ClN2O3S2/c12-8-6-9(18)10(19(13,16)17)5-7(8)11(15)14-3-1-2-4-14/h5-6,18H,1-4H2,(H2,13,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM10882
(6-ethoxy-1,3-benzothiazole-2-sulfonamide | CHEMBL1...)Show InChI InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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Patents
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| Article PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM10890
(1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonam...)Show SMILES NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12 Show InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MCE PC cid PC sid PDB UniChem
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| Article PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM10882
(6-ethoxy-1,3-benzothiazole-2-sulfonamide | CHEMBL1...)Show InChI InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 9
(Homo sapiens (Human)) | BDBM10881
(CHEMBL288100 | MZA3 | Methazolamide | Methazolamid...)Show InChI InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Nischarin
(RAT) | BDBM50334197
(7-Chloro-3-[(imidazolidin-2-yl)imino]indazole hydr...)Show SMILES Clc1cccc2c(N=C3NCCN3)[nH]nc12 |(13.68,-39.86,;13.64,-41.39,;12.29,-42.12,;12.25,-43.67,;13.56,-44.47,;14.92,-43.74,;16.37,-44.25,;17.18,-45.57,;18.71,-45.54,;19.59,-44.27,;21.07,-44.71,;21.09,-46.25,;19.64,-46.76,;17.3,-43.03,;16.43,-41.77,;14.95,-42.2,)| Show InChI InChI=1S/C10H10ClN5/c11-7-3-1-2-6-8(7)15-16-9(6)14-10-12-4-5-13-10/h1-3H,4-5H2,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 30.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM10890
(1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonam...)Show SMILES NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12 Show InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM10882
(6-ethoxy-1,3-benzothiazole-2-sulfonamide | CHEMBL1...)Show InChI InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM50190252
(5-(aminosulfonyl)-N-benzyl-2-chloro-4-mercaptobenz...)Show InChI InChI=1S/C14H13ClN2O3S2/c15-11-7-12(21)13(22(16,19)20)6-10(11)14(18)17-8-9-4-2-1-3-5-9/h1-7,21H,8H2,(H,17,18)(H2,16,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 35.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM10883
(4,5-dichlorobenzene-1,3-disulfonamide | CHEMBL17 |...)Show InChI InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
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| DrugBank MMDB PDB Article PubMed
| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50190252
(5-(aminosulfonyl)-N-benzyl-2-chloro-4-mercaptobenz...)Show InChI InChI=1S/C14H13ClN2O3S2/c15-11-7-12(21)13(22(16,19)20)6-10(11)14(18)17-8-9-4-2-1-3-5-9/h1-7,21H,8H2,(H,17,18)(H2,16,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 40.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Nischarin
(RAT) | BDBM50334195
(4-Chloro-3-[(imidazolidin-2-yl)imino]indazole hydr...)Show SMILES Clc1cccc2n[nH]c(N=C3NCCN3)c12 |(20.22,-2.74,;20.26,-1.21,;18.95,-.4,;18.99,1.14,;20.34,1.87,;21.66,1.07,;23.13,1.5,;24.01,.23,;23.07,-.99,;23.88,-2.31,;25.41,-2.28,;26.29,-1.01,;27.77,-1.45,;27.8,-2.99,;26.34,-3.5,;21.62,-.47,)| Show InChI InChI=1S/C10H10ClN5/c11-6-2-1-3-7-8(6)9(16-15-7)14-10-12-4-5-13-10/h1-3H,4-5H2,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 45.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM10883
(4,5-dichlorobenzene-1,3-disulfonamide | CHEMBL17 |...)Show InChI InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM10883
(4,5-dichlorobenzene-1,3-disulfonamide | CHEMBL17 |...)Show InChI InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
| Article PubMed
| 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM50190250
(2-chloro-4-mercapto-5-sulfamoyl-benzoic acid ethyl...)Show InChI InChI=1S/C9H10ClNO4S2/c1-2-15-9(12)5-3-8(17(11,13)14)7(16)4-6(5)10/h3-4,16H,2H2,1H3,(H2,11,13,14) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50190250
(2-chloro-4-mercapto-5-sulfamoyl-benzoic acid ethyl...)Show InChI InChI=1S/C9H10ClNO4S2/c1-2-15-9(12)5-3-8(17(11,13)14)7(16)4-6(5)10/h3-4,16H,2H2,1H3,(H2,11,13,14) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM50190254
(6-(methylthio)-3,4-dihydro-2H-1,2,4-benzothiadiazi...)Show InChI InChI=1S/C8H11N3O4S3/c1-16-6-2-5-7(3-8(6)17(9,12)13)18(14,15)11-4-10-5/h2-3,10-11H,4H2,1H3,(H2,9,12,13) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 108 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 113 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 9
(Homo sapiens (Human)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 115 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 117 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 12
(Homo sapiens (Human)) | BDBM50190241
(6-mercapto-3,4-dihydro-2H-1,2,4-benzothiadiazine-7...)Show InChI InChI=1S/C7H9N3O4S3/c8-16(11,12)7-2-6-4(1-5(7)15)9-3-10-17(6,13)14/h1-2,9-10,15H,3H2,(H2,8,11,12) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 118 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Nischarin
(RAT) | BDBM50334196
(3-[(Imidazolidin-2-yl)imino]-4-methylindazole hydr...)Show SMILES Cc1cccc2n[nH]c(N=C3NCCN3)c12 |(-5.16,-15.24,;-5.12,-13.71,;-6.43,-12.91,;-6.38,-11.36,;-5.04,-10.63,;-3.72,-11.44,;-2.24,-11.01,;-1.37,-12.27,;-2.31,-13.49,;-1.5,-14.81,;.03,-14.78,;.91,-13.51,;2.39,-13.95,;2.42,-15.49,;.97,-16,;-3.76,-12.98,)| Show InChI InChI=1S/C11H13N5/c1-7-3-2-4-8-9(7)10(16-15-8)14-11-12-5-6-13-11/h2-4H,5-6H2,1H3,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 133 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50334194
(3-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)Show SMILES C1CNC(N1)=Nc1[nH]nc2ccccc12 |(1.21,-.87,;1.24,-2.41,;-.21,-2.92,;-1.14,-1.7,;-.27,-.43,;-2.68,-1.73,;-3.49,-.41,;-2.55,.82,;-3.42,2.08,;-4.9,1.65,;-6.21,2.45,;-7.56,1.72,;-7.61,.18,;-6.29,-.63,;-4.93,.11,)| Show InChI InChI=1S/C10H11N5/c1-2-4-8-7(3-1)9(15-14-8)13-10-11-5-6-12-10/h1-4H,5-6H2,(H3,11,12,13,14,15) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 134 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50190254
(6-(methylthio)-3,4-dihydro-2H-1,2,4-benzothiadiazi...)Show InChI InChI=1S/C8H11N3O4S3/c1-16-6-2-5-7(3-8(6)17(9,12)13)18(14,15)11-4-10-5/h2-3,10-11H,4H2,1H3,(H2,9,12,13) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 139 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Nischarin
(RAT) | BDBM50334206
(3-[(Imidazolidin-2-yl)imino]-4-methoxyindazole hyd...)Show SMILES COc1cccc2n[nH]c(N=C3NCCN3)c12 |(13.29,-18.77,;14.63,-18.04,;14.68,-16.51,;13.36,-15.7,;13.41,-14.16,;14.76,-13.43,;16.07,-14.23,;17.55,-13.8,;18.42,-15.07,;17.48,-16.29,;18.29,-17.61,;19.83,-17.58,;20.71,-16.31,;22.18,-16.75,;22.21,-18.29,;20.76,-18.8,;16.04,-15.77,)| Show InChI InChI=1S/C11H13N5O/c1-17-8-4-2-3-7-9(8)10(16-15-7)14-11-12-5-6-13-11/h2-4H,5-6H2,1H3,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 167 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50190251
(4-chloro-2-({5-chloro-4-[(pyrrolidin-1-yl)carbonyl...)Show SMILES NS(=O)(=O)c1cc(C(=O)N2CCCC2)c(Cl)cc1SSc1cc(Cl)c(cc1S(N)(=O)=O)C(=O)N1CCCC1 Show InChI InChI=1S/C22H24Cl2N4O6S4/c23-15-11-17(19(37(25,31)32)9-13(15)21(29)27-5-1-2-6-27)35-36-18-12-16(24)14(10-20(18)38(26,33)34)22(30)28-7-3-4-8-28/h9-12H,1-8H2,(H2,25,31,32)(H2,26,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 190 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190249
(2-(5-chloro-4-methyl-2-sulfamoyl-benzenesulfonyl)-...)Show SMILES COC(=O)C(C)S(=O)(=O)c1cc(Cl)c(C)cc1S(N)(=O)=O Show InChI InChI=1S/C11H14ClNO6S2/c1-6-4-10(21(13,17)18)9(5-8(6)12)20(15,16)7(2)11(14)19-3/h4-5,7H,1-3H3,(H2,13,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 244 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |
Nischarin
(RAT) | BDBM50334204
(3-[(Imidazolidin-2-yl)imino]-6-methylindazole hydr...)Show SMILES Cc1ccc2c(N=C3NCCN3)[nH]nc2c1 |(-5.95,-39.45,;-4.64,-40.25,;-4.69,-41.79,;-3.37,-42.6,;-2.01,-41.86,;-.57,-42.38,;.24,-43.7,;1.78,-43.67,;2.66,-42.4,;4.13,-42.84,;4.16,-44.38,;2.71,-44.89,;.37,-41.16,;-.5,-39.9,;-1.98,-40.32,;-3.29,-39.52,)| Show InChI InChI=1S/C11H13N5/c1-7-2-3-8-9(6-7)15-16-10(8)14-11-12-4-5-13-11/h2-3,6H,4-5H2,1H3,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 325 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Nischarin
(RAT) | BDBM50334203
(6-Chloro-3-[(imidazolidin-2-yl)imino]indazole hydr...)Show SMILES Clc1ccc2c(N=C3NCCN3)[nH]nc2c1 |(31.19,-27.47,;32.5,-28.27,;32.46,-29.82,;33.77,-30.62,;35.13,-29.89,;36.58,-30.4,;37.39,-31.72,;38.92,-31.69,;39.8,-30.42,;41.28,-30.86,;41.3,-32.4,;39.85,-32.91,;37.51,-29.18,;36.64,-27.92,;35.17,-28.35,;33.85,-27.54,)| Show InChI InChI=1S/C10H10ClN5/c11-6-1-2-7-8(5-6)15-16-9(7)14-10-12-3-4-13-10/h1-2,5H,3-4H2,(H3,12,13,14,15,16) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 410 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Medical University of Gdansk
Curated by ChEMBL
| Assay Description Displacement of [3H]2BFI from imidazoline I1 receptor in Sprague-Dawley rat brain membrane after 45 mins by liquid scintillation counting |
Bioorg Med Chem 19: 321-9 (2011)
Article DOI: 10.1016/j.bmc.2010.11.020 BindingDB Entry DOI: 10.7270/Q2FQ9WX5 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50190240
(4-chloro-2-(1-hydrazinocarbonyl-ethanesulfonyl)-5-...)Show SMILES CC(C(=O)NN)S(=O)(=O)c1cc(Cl)c(C)cc1S(N)(=O)=O Show InChI InChI=1S/C10H14ClN3O5S2/c1-5-3-9(21(13,18)19)8(4-7(5)11)20(16,17)6(2)10(15)14-12/h3-4,6H,12H2,1-2H3,(H,14,15)(H2,13,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 536 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 2
(Homo sapiens (Human)) | BDBM50190245
((5-chloro-4-methyl-2-sulfamoyl-benzenesulfonyl)-ac...)Show InChI InChI=1S/C9H10ClNO6S2/c1-5-2-8(19(11,16)17)7(3-6(5)10)18(14,15)4-9(12)13/h2-3H,4H2,1H3,(H,12,13)(H2,11,16,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 547 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 9
(Homo sapiens (Human)) | BDBM50190251
(4-chloro-2-({5-chloro-4-[(pyrrolidin-1-yl)carbonyl...)Show SMILES NS(=O)(=O)c1cc(C(=O)N2CCCC2)c(Cl)cc1SSc1cc(Cl)c(cc1S(N)(=O)=O)C(=O)N1CCCC1 Show InChI InChI=1S/C22H24Cl2N4O6S4/c23-15-11-17(19(37(25,31)32)9-13(15)21(29)27-5-1-2-6-27)35-36-18-12-16(24)14(10-20(18)38(26,33)34)22(30)28-7-3-4-8-28/h9-12H,1-8H2,(H2,25,31,32)(H2,26,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 766 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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)) | BDBM10881
(CHEMBL288100 | MZA3 | Methazolamide | Methazolamid...)Show InChI InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| 780 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | 3D Structure (crystal) |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50190243
(6-{[7-(aminosulfonyl)-1,1-dioxido-3,4-dihydro-2H-1...)Show SMILES NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1SSc1cc2NCNS(=O)(=O)c2cc1S(N)(=O)=O Show InChI InChI=1S/C14H16N6O8S6/c15-31(21,22)13-3-11-7(17-5-19-33(11,25)26)1-9(13)29-30-10-2-8-12(4-14(10)32(16,23)24)34(27,28)20-6-18-8/h1-4,17-20H,5-6H2,(H2,15,21,22)(H2,16,23,24) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 780 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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 | |