Found 361 hits with Last Name = 'ulus' and Initial = 'r' 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 2
(Homo sapiens (Human)) | BDBM50180265
(CHEMBL3814523)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(Cl)cc2)C(=O)CCC3)s1 |c:19,22| Show InChI InChI=1S/C28H24ClN5O5S2/c29-17-11-7-15(8-12-17)23-24-19(3-1-5-21(24)35)34(20-4-2-6-22(36)25(20)23)18-13-9-16(10-14-18)26(37)31-27-32-33-28(40-27)41(30,38)39/h7-14,23H,1-6H2,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180247
(CHEMBL3814242)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccccc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H33N5O5S2/c1-31(2)14-21-26(23(38)16-31)25(18-8-6-5-7-9-18)27-22(15-32(3,4)17-24(27)39)37(21)20-12-10-19(11-13-20)28(40)34-29-35-36-30(43-29)44(33,41)42/h5-13,25H,14-17H2,1-4H3,(H2,33,41,42)(H,34,35,40) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180248
(CHEMBL3813924)Show InChI InChI=1S/C9H9N5O3S2/c10-6-3-1-5(2-4-6)7(15)12-8-13-14-9(18-8)19(11,16)17/h1-4H,10H2,(H2,11,16,17)(H,12,13,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180249
(CHEMBL3814487)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)[N+]([O-])=O)s1 Show InChI InChI=1S/C9H7N5O5S2/c10-21(18,19)9-13-12-8(20-9)11-7(15)5-1-3-6(4-2-5)14(16)17/h1-4H,(H2,10,18,19)(H,11,12,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180263
(CHEMBL3814420)Show SMILES Cc1ccc(cc1)C1C2=C(CCCC2=O)N(C2=C1C(=O)CCC2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:18,t:9| Show InChI InChI=1S/C29H27N5O5S2/c1-16-8-10-17(11-9-16)24-25-20(4-2-6-22(25)35)34(21-5-3-7-23(36)26(21)24)19-14-12-18(13-15-19)27(37)31-28-32-33-29(40-28)41(30,38)39/h8-15,24H,2-7H2,1H3,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180245
(CHEMBL3814808)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(cc2)C#N)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C33H32N6O5S2/c1-32(2)13-22-27(24(40)15-32)26(19-7-5-18(17-34)6-8-19)28-23(14-33(3,4)16-25(28)41)39(22)21-11-9-20(10-12-21)29(42)36-30-37-38-31(45-30)46(35,43)44/h5-12,26H,13-16H2,1-4H3,(H2,35,43,44)(H,36,37,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 2.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180250
(CHEMBL3814927)Show SMILES CSc1ccc(cc1)C1C2=C(CCCC2=O)N(C2=C1C(=O)CCC2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:19,t:10| Show InChI InChI=1S/C29H27N5O5S3/c1-40-19-14-10-16(11-15-19)24-25-20(4-2-6-22(25)35)34(21-5-3-7-23(36)26(21)24)18-12-8-17(9-13-18)27(37)31-28-32-33-29(41-28)42(30,38)39/h8-15,24H,2-7H2,1H3,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB Article PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180244
(CHEMBL3814117)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(F)cc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32FN5O5S2/c1-31(2)13-21-26(23(39)15-31)25(17-5-9-19(33)10-6-17)27-22(14-32(3,4)16-24(27)40)38(21)20-11-7-18(8-12-20)28(41)35-29-36-37-30(44-29)45(34,42)43/h5-12,25H,13-16H2,1-4H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180264
(CHEMBL3814976)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(Br)cc2)C(=O)CCC3)s1 |c:19,22| Show InChI InChI=1S/C28H24BrN5O5S2/c29-17-11-7-15(8-12-17)23-24-19(3-1-5-21(24)35)34(20-4-2-6-22(36)25(20)23)18-13-9-16(10-14-18)26(37)31-27-32-33-28(40-27)41(30,38)39/h7-14,23H,1-6H2,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180248
(CHEMBL3813924)Show InChI InChI=1S/C9H9N5O3S2/c10-6-3-1-5(2-4-6)7(15)12-8-13-14-9(18-8)19(11,16)17/h1-4H,10H2,(H2,11,16,17)(H,12,13,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180246
(CHEMBL3814309)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)C#N)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C33H32N6O5S2/c1-32(2)13-22-27(24(40)15-32)26(20-7-5-6-18(12-20)17-34)28-23(14-33(3,4)16-25(28)41)39(22)21-10-8-19(9-11-21)29(42)36-30-37-38-31(45-30)46(35,43)44/h5-12,26H,13-16H2,1-4H3,(H2,35,43,44)(H,36,37,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50493068
(CHEMBL2419992)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccccc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H37N3O5S/c1-35(2)18-27-32(29(40)20-35)31(22-8-6-5-7-9-22)33-28(19-36(3,4)21-30(33)41)39(27)25-14-10-23(11-15-25)34(42)38-24-12-16-26(17-13-24)45(37,43)44/h5-17,31H,18-21H2,1-4H3,(H,38,42)(H2,37,43,44) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180249
(CHEMBL3814487)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)[N+]([O-])=O)s1 Show InChI InChI=1S/C9H7N5O5S2/c10-21(18,19)9-13-12-8(20-9)11-7(15)5-1-3-6(4-2-5)14(16)17/h1-4H,(H2,10,18,19)(H,11,12,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180267
(CHEMBL3814163)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cc(Br)ccc2O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32BrN5O6S2/c1-31(2)12-20-26(23(40)14-31)25(19-11-17(33)7-10-22(19)39)27-21(13-32(3,4)15-24(27)41)38(20)18-8-5-16(6-9-18)28(42)35-29-36-37-30(45-29)46(34,43)44/h5-11,25,39H,12-15H2,1-4H3,(H2,34,43,44)(H,35,36,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180243
(CHEMBL3815152)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(Cl)cc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32ClN5O5S2/c1-31(2)13-21-26(23(39)15-31)25(17-5-9-19(33)10-6-17)27-22(14-32(3,4)16-24(27)40)38(21)20-11-7-18(8-12-20)28(41)35-29-36-37-30(44-29)45(34,42)43/h5-12,25H,13-16H2,1-4H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180239
(CHEMBL3814664)Show SMILES Cc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:20,t:9| Show InChI InChI=1S/C33H35N5O5S2/c1-18-6-8-19(9-7-18)26-27-22(14-32(2,3)16-24(27)39)38(23-15-33(4,5)17-25(40)28(23)26)21-12-10-20(11-13-21)29(41)35-30-36-37-31(44-30)45(34,42)43/h6-13,26H,14-17H2,1-5H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50493062
(CHEMBL2419987)Show SMILES COc1cccc(C2C3=C(CC(C)(C)CC3=O)N(C3=C2C(=O)CC(C)(C)C3)c2ccc(cc2)C(=O)Nc2ccc(cc2)S(N)(=O)=O)c1O |c:19,t:8| Show InChI InChI=1S/C37H39N3O7S/c1-36(2)17-26-32(28(41)19-36)31(25-7-6-8-30(47-5)34(25)43)33-27(18-37(3,4)20-29(33)42)40(26)23-13-9-21(10-14-23)35(44)39-22-11-15-24(16-12-22)48(38,45)46/h6-16,31,43H,17-20H2,1-5H3,(H,39,44)(H2,38,45,46) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180241
(CHEMBL3813758)Show SMILES COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:21,t:10| Show InChI InChI=1S/C33H35N5O6S2/c1-32(2)14-22-27(24(39)16-32)26(18-8-12-21(44-5)13-9-18)28-23(15-33(3,4)17-25(28)40)38(22)20-10-6-19(7-11-20)29(41)35-30-36-37-31(45-30)46(34,42)43/h6-13,26H,14-17H2,1-5H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180238
(CHEMBL3814802)Show SMILES CCc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:21,t:10| Show InChI InChI=1S/C34H37N5O5S2/c1-6-19-7-9-20(10-8-19)27-28-23(15-33(2,3)17-25(28)40)39(24-16-34(4,5)18-26(41)29(24)27)22-13-11-21(12-14-22)30(42)36-31-37-38-32(45-31)46(35,43)44/h7-14,27H,6,15-18H2,1-5H3,(H2,35,43,44)(H,36,37,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180247
(CHEMBL3814242)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccccc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H33N5O5S2/c1-31(2)14-21-26(23(38)16-31)25(18-8-6-5-7-9-18)27-22(15-32(3,4)17-24(27)39)37(21)20-12-10-19(11-13-20)28(40)34-29-35-36-30(43-29)44(33,41)42/h5-13,25H,14-17H2,1-4H3,(H2,33,41,42)(H,34,35,40) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human carbonic anhydrase 12 catalytic domain expressed in Escherichia coli incubated for 15 mins prior to testing by stoppe... |
Bioorg Med Chem 23: 6573-80 (2015)
Article DOI: 10.1016/j.bmc.2015.09.022 BindingDB Entry DOI: 10.7270/Q21Z4668 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50180244
(CHEMBL3814117)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(F)cc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32FN5O5S2/c1-31(2)13-21-26(23(39)15-31)25(17-5-9-19(33)10-6-17)27-22(14-32(3,4)16-24(27)40)38(21)20-11-7-18(8-12-20)28(41)35-29-36-37-30(44-29)45(34,42)43/h5-12,25H,13-16H2,1-4H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA1 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180240
(CHEMBL3814887)Show SMILES CSc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:21,t:10| Show InChI InChI=1S/C33H35N5O5S3/c1-32(2)14-22-27(24(39)16-32)26(18-8-12-21(44-5)13-9-18)28-23(15-33(3,4)17-25(28)40)38(22)20-10-6-19(7-11-20)29(41)35-30-36-37-31(45-30)46(34,42)43/h6-13,26H,14-17H2,1-5H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180263
(CHEMBL3814420)Show SMILES Cc1ccc(cc1)C1C2=C(CCCC2=O)N(C2=C1C(=O)CCC2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:18,t:9| Show InChI InChI=1S/C29H27N5O5S2/c1-16-8-10-17(11-9-16)24-25-20(4-2-6-22(25)35)34(21-5-3-7-23(36)26(21)24)19-14-12-18(13-15-19)27(37)31-28-32-33-29(40-28)41(30,38)39/h8-15,24H,2-7H2,1H3,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| 8.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180244
(CHEMBL3814117)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(F)cc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32FN5O5S2/c1-31(2)13-21-26(23(39)15-31)25(17-5-9-19(33)10-6-17)27-22(14-32(3,4)16-24(27)40)38(21)20-11-7-18(8-12-20)28(41)35-29-36-37-30(44-29)45(34,42)43/h5-12,25H,13-16H2,1-4H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180266
(CHEMBL3814942)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(Cl)cc2Cl)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H31Cl2N5O5S2/c1-31(2)12-21-26(23(40)14-31)25(19-10-7-17(33)11-20(19)34)27-22(13-32(3,4)15-24(27)41)39(21)18-8-5-16(6-9-18)28(42)36-29-37-38-30(45-29)46(35,43)44/h5-11,25H,12-15H2,1-4H3,(H2,35,43,44)(H,36,37,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180236
(CHEMBL3814449)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)C2C3=C(CC(C)(C)CC3=O)N(C3=C2C(=O)CC(C)(C)C3)c2ccc(cc2)C(=O)Nc2nnc(s2)S(N)(=O)=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11,34,t:23| Show InChI InChI=1S/C58H60N10O10S4/c1-55(2)21-35-45(39(69)25-55)43(46-36(22-56(3,4)26-40(46)70)67(35)33-16-12-29(13-17-33)49(73)61-51-63-65-53(79-51)81(59,75)76)31-10-9-11-32(20-31)44-47-37(23-57(5,6)27-41(47)71)68(38-24-58(7,8)28-42(72)48(38)44)34-18-14-30(15-19-34)50(74)62-52-64-66-54(80-52)82(60,77)78/h9-20,43-44H,21-28H2,1-8H3,(H2,59,75,76)(H2,60,77,78)(H,61,63,73)(H,62,64,74) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 9.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180250
(CHEMBL3814927)Show SMILES CSc1ccc(cc1)C1C2=C(CCCC2=O)N(C2=C1C(=O)CCC2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:19,t:10| Show InChI InChI=1S/C29H27N5O5S3/c1-40-19-14-10-16(11-15-19)24-25-20(4-2-6-22(25)35)34(21-5-3-7-23(36)26(21)24)18-12-8-17(9-13-18)27(37)31-28-32-33-29(41-28)42(30,38)39/h8-15,24H,2-7H2,1H3,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180265
(CHEMBL3814523)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(Cl)cc2)C(=O)CCC3)s1 |c:19,22| Show InChI InChI=1S/C28H24ClN5O5S2/c29-17-11-7-15(8-12-17)23-24-19(3-1-5-21(24)35)34(20-4-2-6-22(36)25(20)23)18-13-9-16(10-14-18)26(37)31-27-32-33-28(40-27)41(30,38)39/h7-14,23H,1-6H2,(H2,30,38,39)(H,31,32,37) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank MMDB PDB Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank MMDB PDB Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank MMDB PDB Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human carbonic anhydrase 2 expressed in Escherichia coli incubated for 15 mins prior to testing by stopped flow CO2 hydrase... |
Bioorg Med Chem 23: 6573-80 (2015)
Article DOI: 10.1016/j.bmc.2015.09.022 BindingDB Entry DOI: 10.7270/Q21Z4668 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50493070
(CHEMBL2419988)Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(cc2)C#N)C(=O)CCC3)cc1 |c:19,22| Show InChI InChI=1S/C33H28N4O5S/c34-19-20-7-9-21(10-8-20)30-31-26(3-1-5-28(31)38)37(27-4-2-6-29(39)32(27)30)24-15-11-22(12-16-24)33(40)36-23-13-17-25(18-14-23)43(35,41)42/h7-18,30H,1-6H2,(H,36,40)(H2,35,41,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493067
(CHEMBL2419994)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)C#N)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C37H36N4O5S/c1-36(2)17-28-33(30(42)19-36)32(24-7-5-6-22(16-24)21-38)34-29(18-37(3,4)20-31(34)43)41(28)26-12-8-23(9-13-26)35(44)40-25-10-14-27(15-11-25)47(39,45)46/h5-16,32H,17-20H2,1-4H3,(H,40,44)(H2,39,45,46) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50180235
(CHEMBL3814291)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(cc2)C2C3=C(CC(C)(C)CC3=O)N(C3=C2C(=O)CC(C)(C)C3)c2ccc(cc2)C(=O)Nc2nnc(s2)S(N)(=O)=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11,34,t:23| Show InChI InChI=1S/C58H60N10O10S4/c1-55(2)21-35-45(39(69)25-55)43(46-36(22-56(3,4)26-40(46)70)67(35)33-17-13-31(14-18-33)49(73)61-51-63-65-53(79-51)81(59,75)76)29-9-11-30(12-10-29)44-47-37(23-57(5,6)27-41(47)71)68(38-24-58(7,8)28-42(72)48(38)44)34-19-15-32(16-20-34)50(74)62-52-64-66-54(80-52)82(60,77)78/h9-20,43-44H,21-28H2,1-8H3,(H2,59,75,76)(H2,60,77,78)(H,61,63,73)(H,62,64,74) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA2 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493068
(CHEMBL2419992)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccccc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H37N3O5S/c1-35(2)18-27-32(29(40)20-35)31(22-8-6-5-7-9-22)33-28(19-36(3,4)21-30(33)41)39(27)25-14-10-23(11-15-25)34(42)38-24-12-16-26(17-13-24)45(37,43)44/h5-17,31H,18-21H2,1-4H3,(H,38,42)(H2,37,43,44) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180236
(CHEMBL3814449)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)C2C3=C(CC(C)(C)CC3=O)N(C3=C2C(=O)CC(C)(C)C3)c2ccc(cc2)C(=O)Nc2nnc(s2)S(N)(=O)=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11,34,t:23| Show InChI InChI=1S/C58H60N10O10S4/c1-55(2)21-35-45(39(69)25-55)43(46-36(22-56(3,4)26-40(46)70)67(35)33-16-12-29(13-17-33)49(73)61-51-63-65-53(79-51)81(59,75)76)31-10-9-11-32(20-31)44-47-37(23-57(5,6)27-41(47)71)68(38-24-58(7,8)28-42(72)48(38)44)34-18-14-30(15-19-34)50(74)62-52-64-66-54(80-52)82(60,77)78/h9-20,43-44H,21-28H2,1-8H3,(H2,59,75,76)(H2,60,77,78)(H,61,63,73)(H,62,64,74) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50493075
(CHEMBL2419989)Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(Cl)cc2Cl)C(=O)CCC3)cc1 |c:19,22| Show InChI InChI=1S/C32H27Cl2N3O5S/c33-19-9-16-23(24(34)17-19)29-30-25(3-1-5-27(30)38)37(26-4-2-6-28(39)31(26)29)21-12-7-18(8-13-21)32(40)36-20-10-14-22(15-11-20)43(35,41)42/h7-17,29H,1-6H2,(H,36,40)(H2,35,41,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493065
(CHEMBL2419979)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(Cl)cc2)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H36ClN3O5S/c1-35(2)17-27-32(29(41)19-35)31(21-5-9-23(37)10-6-21)33-28(18-36(3,4)20-30(33)42)40(27)25-13-7-22(8-14-25)34(43)39-24-11-15-26(16-12-24)46(38,44)45/h5-16,31H,17-20H2,1-4H3,(H,39,43)(H2,38,44,45) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180241
(CHEMBL3813758)Show SMILES COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)N(C2=C1C(=O)CC(C)(C)C2)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:21,t:10| Show InChI InChI=1S/C33H35N5O6S2/c1-32(2)14-22-27(24(39)16-32)26(18-8-12-21(44-5)13-9-18)28-23(15-33(3,4)17-25(28)40)38(22)20-10-6-19(7-11-20)29(41)35-30-36-37-31(45-30)46(34,42)43/h6-13,26H,14-17H2,1-5H3,(H2,34,42,43)(H,35,36,41) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493077
(CHEMBL2419986)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(Cl)cc2Cl)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H35Cl2N3O5S/c1-35(2)16-27-32(29(42)18-35)31(25-14-7-21(37)15-26(25)38)33-28(17-36(3,4)19-30(33)43)41(27)23-10-5-20(6-11-23)34(44)40-22-8-12-24(13-9-22)47(39,45)46/h5-15,31H,16-19H2,1-4H3,(H,40,44)(H2,39,45,46) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493066
(CHEMBL2419977)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)[N+]([O-])=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H36N4O7S/c1-35(2)17-27-32(29(41)19-35)31(22-6-5-7-25(16-22)40(44)45)33-28(18-36(3,4)20-30(33)42)39(27)24-12-8-21(9-13-24)34(43)38-23-10-14-26(15-11-23)48(37,46)47/h5-16,31H,17-20H2,1-4H3,(H,38,43)(H2,37,46,47) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
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
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human carbonic anhydrase 9 catalytic domain expressed in Escherichia coli incubated for 15 mins prior to testing by stopped... |
Bioorg Med Chem 23: 6573-80 (2015)
Article DOI: 10.1016/j.bmc.2015.09.022 BindingDB Entry DOI: 10.7270/Q21Z4668 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB Article PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180266
(CHEMBL3814942)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(Cl)cc2Cl)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H31Cl2N5O5S2/c1-31(2)12-21-26(23(40)14-31)25(19-10-7-17(33)11-20(19)34)27-22(13-32(3,4)15-24(27)41)39(21)18-8-5-16(6-9-18)28(42)36-29-37-38-30(45-29)46(35,43)44/h5-11,25H,12-15H2,1-4H3,(H2,35,43,44)(H,36,37,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50180265
(CHEMBL3814523)Show SMILES NS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)N2C3=C(C(C4=C2CCCC4=O)c2ccc(Cl)cc2)C(=O)CCC3)s1 |c:19,22| Show InChI InChI=1S/C28H24ClN5O5S2/c29-17-11-7-15(8-12-17)23-24-19(3-1-5-21(24)35)34(20-4-2-6-22(36)25(20)23)18-13-9-16(10-14-18)26(37)31-27-32-33-28(40-27)41(30,38)39/h7-14,23H,1-6H2,(H2,30,38,39)(H,31,32,37) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant CA1 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493073
(CHEMBL2419976)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(cc2)[N+]([O-])=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C36H36N4O7S/c1-35(2)17-27-32(29(41)19-35)31(21-5-13-25(14-6-21)40(44)45)33-28(18-36(3,4)20-30(33)42)39(27)24-11-7-22(8-12-24)34(43)38-23-9-15-26(16-10-23)48(37,46)47/h5-16,31H,17-20H2,1-4H3,(H,38,43)(H2,37,46,47) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50180267
(CHEMBL3814163)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cc(Br)ccc2O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O |c:6,11| Show InChI InChI=1S/C32H32BrN5O6S2/c1-31(2)12-20-26(23(40)14-31)25(19-11-17(33)7-10-22(19)39)27-21(13-32(3,4)15-24(27)41)38(20)18-8-5-16(6-9-18)28(42)35-29-36-37-30(45-29)46(34,43)44/h5-11,25,39H,12-15H2,1-4H3,(H2,34,43,44)(H,35,36,42) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant membrane bound CA7 expressed in Escherichia coli preincubated for 15 mins by stopped-flow CO2 hydration assay |
Bioorg Med Chem 24: 3548-55 (2016)
Article DOI: 10.1016/j.bmc.2016.05.064 BindingDB Entry DOI: 10.7270/Q2N29ZVD |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50493069
(CHEMBL2419991)Show SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2cccc(c2)C2C3=C(CC(C)(C)CC3=O)N(C3=C2C(=O)CC(C)(C)C3)c2ccc(cc2)C(=O)Nc2ccc(cc2)S(N)(=O)=O)C(=O)CC(C)(C)C1)c1ccc(cc1)C(=O)Nc1ccc(cc1)S(N)(=O)=O |c:6,11,34,t:23| Show InChI InChI=1S/C66H68N6O10S2/c1-63(2)29-47-57(51(73)33-63)55(58-48(30-64(3,4)34-52(58)74)71(47)43-20-12-37(13-21-43)61(77)69-41-16-24-45(25-17-41)83(67,79)80)39-10-9-11-40(28-39)56-59-49(31-65(5,6)35-53(59)75)72(50-32-66(7,8)36-54(76)60(50)56)44-22-14-38(15-23-44)62(78)70-42-18-26-46(27-19-42)84(68,81)82/h9-28,55-56H,29-36H2,1-8H3,(H,69,77)(H,70,78)(H2,67,79,80)(H2,68,81,82) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlup?nar University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
Bioorg Med Chem 21: 5799-805 (2013)
Article DOI: 10.1016/j.bmc.2013.07.014 BindingDB Entry DOI: 10.7270/Q2DB84SS |
More data for this Ligand-Target Pair | |