Found 102 hits with Last Name = 'alsaif' and Initial = 'na' 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 9
(Homo sapiens (Human)) | BDBM50515509
(CHEMBL4555163)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C22H14ClN3O7S/c23-12-2-8-18(17(10-12)22(30)31)25-19(27)11-1-7-15-16(9-11)21(29)26(20(15)28)13-3-5-14(6-4-13)34(24,32)33/h1-10H,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 3.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50334354
(4-(3-(4-fluorophenyl)ureido)benzenesulfonamide | 4...)Show InChI InChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 4.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515519
(CHEMBL4475456)Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C24H18ClN3O7S/c25-15-4-8-20(19(12-15)24(32)33)27-21(29)14-3-7-17-18(11-14)23(31)28(22(17)30)10-9-13-1-5-16(6-2-13)36(26,34)35/h1-8,11-12H,9-10H2,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 4.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
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
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515511
(CHEMBL4466506)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(CCc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C25H21N3O8S/c1-36-16-5-9-21(20(13-16)25(32)33)27-22(29)15-4-8-18-19(12-15)24(31)28(23(18)30)11-10-14-2-6-17(7-3-14)37(26,34)35/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 6.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515519
(CHEMBL4475456)Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C24H18ClN3O7S/c25-15-4-8-20(19(12-15)24(32)33)27-21(29)14-3-7-17-18(11-14)23(31)28(22(17)30)10-9-13-1-5-16(6-2-13)36(26,34)35/h1-8,11-12H,9-10H2,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 7.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515511
(CHEMBL4466506)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(CCc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C25H21N3O8S/c1-36-16-5-9-21(20(13-16)25(32)33)27-22(29)15-4-8-18-19(12-15)24(31)28(23(18)30)11-10-14-2-6-17(7-3-14)37(26,34)35/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 8.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515516
(CHEMBL4449914)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)S(N)(=O)=O)c(c1)C(O)=O Show InChI InChI=1S/C23H17N3O8S/c1-34-14-5-9-19(18(11-14)23(30)31)25-20(27)12-2-8-16-17(10-12)22(29)26(21(16)28)13-3-6-15(7-4-13)35(24,32)33/h2-11H,1H3,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 8.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515511
(CHEMBL4466506)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(CCc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C25H21N3O8S/c1-36-16-5-9-21(20(13-16)25(32)33)27-22(29)15-4-8-18-19(12-15)24(31)28(23(18)30)11-10-14-2-6-17(7-3-14)37(26,34)35/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 8.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515509
(CHEMBL4555163)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C22H14ClN3O7S/c23-12-2-8-18(17(10-12)22(30)31)25-19(27)11-1-7-15-16(9-11)21(29)26(20(15)28)13-3-5-14(6-4-13)34(24,32)33/h1-10H,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 9.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515516
(CHEMBL4449914)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)S(N)(=O)=O)c(c1)C(O)=O Show InChI InChI=1S/C23H17N3O8S/c1-34-14-5-9-19(18(11-14)23(30)31)25-20(27)12-2-8-16-17(10-12)22(29)26(21(16)28)13-3-6-15(7-4-13)35(24,32)33/h2-11H,1H3,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
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
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515519
(CHEMBL4475456)Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C24H18ClN3O7S/c25-15-4-8-20(19(12-15)24(32)33)27-21(29)14-3-7-17-18(11-14)23(31)28(22(17)30)10-9-13-1-5-16(6-2-13)36(26,34)35/h1-8,11-12H,9-10H2,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515509
(CHEMBL4555163)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C22H14ClN3O7S/c23-12-2-8-18(17(10-12)22(30)31)25-19(27)11-1-7-15-16(9-11)21(29)26(20(15)28)13-3-5-14(6-4-13)34(24,32)33/h1-10H,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515518
(CHEMBL4517297)Show SMILES NS(=O)(=O)c1ccc(CN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C23H16ClN3O7S/c24-14-4-8-19(18(10-14)23(31)32)26-20(28)13-3-7-16-17(9-13)22(30)27(21(16)29)11-12-1-5-15(6-2-12)35(25,33)34/h1-10H,11H2,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
NCI pathway 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 |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
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
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515516
(CHEMBL4449914)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)S(N)(=O)=O)c(c1)C(O)=O Show InChI InChI=1S/C23H17N3O8S/c1-34-14-5-9-19(18(11-14)23(30)31)25-20(27)12-2-8-16-17(10-12)22(29)26(21(16)28)13-3-6-15(7-4-13)35(24,32)33/h2-11H,1H3,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50500025
(CHEMBL3740241)Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc2C(=O)OC(=O)c2c1 Show InChI InChI=1S/C16H8ClNO6/c17-8-2-4-12(11(6-8)14(20)21)18-13(19)7-1-3-9-10(5-7)16(23)24-15(9)22/h1-6H,(H,18,19)(H,20,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515510
(CHEMBL4547526)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C24H19N3O8S/c1-35-15-5-9-20(19(11-15)24(31)32)26-21(28)14-4-8-17-18(10-14)23(30)27(22(17)29)12-13-2-6-16(7-3-13)36(25,33)34/h2-11H,12H2,1H3,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 36 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515518
(CHEMBL4517297)Show SMILES NS(=O)(=O)c1ccc(CN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C23H16ClN3O7S/c24-14-4-8-19(18(10-14)23(31)32)26-20(28)13-3-7-16-17(9-13)22(30)27(21(16)29)11-12-1-5-15(6-2-12)35(25,33)34/h1-10H,11H2,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50334354
(4-(3-(4-fluorophenyl)ureido)benzenesulfonamide | 4...)Show InChI InChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 45 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50500025
(CHEMBL3740241)Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc2C(=O)OC(=O)c2c1 Show InChI InChI=1S/C16H8ClNO6/c17-8-2-4-12(11(6-8)14(20)21)18-13(19)7-1-3-9-10(5-7)16(23)24-15(9)22/h1-6H,(H,18,19)(H,20,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515510
(CHEMBL4547526)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C24H19N3O8S/c1-35-15-5-9-20(19(11-15)24(31)32)26-21(28)14-4-8-17-18(10-14)23(30)27(22(17)29)12-13-2-6-16(7-3-13)36(25,33)34/h2-11H,12H2,1H3,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515510
(CHEMBL4547526)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C24H19N3O8S/c1-35-15-5-9-20(19(11-15)24(31)32)26-21(28)14-4-8-17-18(10-14)23(30)27(22(17)29)12-13-2-6-16(7-3-13)36(25,33)34/h2-11H,12H2,1H3,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 75 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515517
(CHEMBL4452436)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)OC(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C17H11NO7/c1-24-9-3-5-13(12(7-9)15(20)21)18-14(19)8-2-4-10-11(6-8)17(23)25-16(10)22/h2-7H,1H3,(H,18,19)(H,20,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 77 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515516
(CHEMBL4449914)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)S(N)(=O)=O)c(c1)C(O)=O Show InChI InChI=1S/C23H17N3O8S/c1-34-14-5-9-19(18(11-14)23(30)31)25-20(27)12-2-8-16-17(10-12)22(29)26(21(16)28)13-3-6-15(7-4-13)35(24,32)33/h2-11H,1H3,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 82 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515518
(CHEMBL4517297)Show SMILES NS(=O)(=O)c1ccc(CN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C23H16ClN3O7S/c24-14-4-8-19(18(10-14)23(31)32)26-20(28)13-3-7-16-17(9-13)22(30)27(21(16)29)11-12-1-5-15(6-2-12)35(25,33)34/h1-10H,11H2,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515509
(CHEMBL4555163)Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C22H14ClN3O7S/c23-12-2-8-18(17(10-12)22(30)31)25-19(27)11-1-7-15-16(9-11)21(29)26(20(15)28)13-3-5-14(6-4-13)34(24,32)33/h1-10H,(H,25,27)(H,30,31)(H2,24,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 97 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50500025
(CHEMBL3740241)Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc2C(=O)OC(=O)c2c1 Show InChI InChI=1S/C16H8ClNO6/c17-8-2-4-12(11(6-8)14(20)21)18-13(19)7-1-3-9-10(5-7)16(23)24-15(9)22/h1-6H,(H,18,19)(H,20,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515517
(CHEMBL4452436)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)OC(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C17H11NO7/c1-24-9-3-5-13(12(7-9)15(20)21)18-14(19)8-2-4-10-11(6-8)17(23)25-16(10)22/h2-7H,1H3,(H,18,19)(H,20,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50500025
(CHEMBL3740241)Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc2C(=O)OC(=O)c2c1 Show InChI InChI=1S/C16H8ClNO6/c17-8-2-4-12(11(6-8)14(20)21)18-13(19)7-1-3-9-10(5-7)16(23)24-15(9)22/h1-6H,(H,18,19)(H,20,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515517
(CHEMBL4452436)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)OC(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C17H11NO7/c1-24-9-3-5-13(12(7-9)15(20)21)18-14(19)8-2-4-10-11(6-8)17(23)25-16(10)22/h2-7H,1H3,(H,18,19)(H,20,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515517
(CHEMBL4452436)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)OC(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C17H11NO7/c1-24-9-3-5-13(12(7-9)15(20)21)18-14(19)8-2-4-10-11(6-8)17(23)25-16(10)22/h2-7H,1H3,(H,18,19)(H,20,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515519
(CHEMBL4475456)Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C24H18ClN3O7S/c25-15-4-8-20(19(12-15)24(32)33)27-21(29)14-3-7-17-18(11-14)23(31)28(22(17)30)10-9-13-1-5-16(6-2-13)36(26,34)35/h1-8,11-12H,9-10H2,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 231 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(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
| DrugBank PDB Article PubMed
| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515518
(CHEMBL4517297)Show SMILES NS(=O)(=O)c1ccc(CN2C(=O)c3ccc(cc3C2=O)C(=O)Nc2ccc(Cl)cc2C(O)=O)cc1 Show InChI InChI=1S/C23H16ClN3O7S/c24-14-4-8-19(18(10-14)23(31)32)26-20(28)13-3-7-16-17(9-13)22(30)27(21(16)29)11-12-1-5-15(6-2-12)35(25,33)34/h1-10H,11H2,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 384 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515511
(CHEMBL4466506)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(CCc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C25H21N3O8S/c1-36-16-5-9-21(20(13-16)25(32)33)27-22(29)15-4-8-18-19(12-15)24(31)28(23(18)30)11-10-14-2-6-17(7-3-14)37(26,34)35/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,32,33)(H2,26,34,35) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 416 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50515510
(CHEMBL4547526)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccc(cc4)S(N)(=O)=O)C(=O)c3c2)c(c1)C(O)=O Show InChI InChI=1S/C24H19N3O8S/c1-35-15-5-9-20(19(11-15)24(31)32)26-21(28)14-4-8-17-18(10-14)23(30)27(22(17)29)12-13-2-6-16(7-3-13)36(25,33)34/h2-11H,12H2,1H3,(H,26,28)(H,31,32)(H2,25,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 457 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515523
(CHEMBL4442193)Show SMILES OC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C23H13ClN2O7/c24-13-4-8-18(17(10-13)23(32)33)25-19(27)12-3-7-15-16(9-12)21(29)26(20(15)28)14-5-1-11(2-6-14)22(30)31/h1-10H,(H,25,27)(H,30,31)(H,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515515
(CHEMBL4442248)Show SMILES CCOC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C25H17ClN2O7/c1-2-35-25(34)13-3-7-16(8-4-13)28-22(30)17-9-5-14(11-18(17)23(28)31)21(29)27-20-10-6-15(26)12-19(20)24(32)33/h3-12H,2H2,1H3,(H,27,29)(H,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 530 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515515
(CHEMBL4442248)Show SMILES CCOC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C25H17ClN2O7/c1-2-35-25(34)13-3-7-16(8-4-13)28-22(30)17-9-5-14(11-18(17)23(28)31)21(29)27-20-10-6-15(26)12-19(20)24(32)33/h3-12H,2H2,1H3,(H,27,29)(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 650 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515523
(CHEMBL4442193)Show SMILES OC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C23H13ClN2O7/c24-13-4-8-18(17(10-13)23(32)33)25-19(27)12-3-7-15-16(9-12)21(29)26(20(15)28)14-5-1-11(2-6-14)22(30)31/h1-10H,(H,25,27)(H,30,31)(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 710 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515524
(CHEMBL4521441)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)C(O)=O)c(c1)C(O)=O Show InChI InChI=1S/C24H16N2O8/c1-34-15-7-9-19(18(11-15)24(32)33)25-20(27)13-4-8-16-17(10-13)22(29)26(21(16)28)14-5-2-12(3-6-14)23(30)31/h2-11H,1H3,(H,25,27)(H,30,31)(H,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 720 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515524
(CHEMBL4521441)Show SMILES COc1ccc(NC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2ccc(cc2)C(O)=O)c(c1)C(O)=O Show InChI InChI=1S/C24H16N2O8/c1-34-15-7-9-19(18(11-15)24(32)33)25-20(27)13-4-8-16-17(10-13)22(29)26(21(16)28)14-5-2-12(3-6-14)23(30)31/h2-11H,1H3,(H,25,27)(H,30,31)(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515525
(CHEMBL4569133)Show SMILES CCOC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(OC)cc1C(O)=O Show InChI InChI=1S/C26H20N2O8/c1-3-36-26(34)14-4-7-16(8-5-14)28-23(30)18-10-6-15(12-19(18)24(28)31)22(29)27-21-11-9-17(35-2)13-20(21)25(32)33/h4-13H,3H2,1-2H3,(H,27,29)(H,32,33) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 960 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50334354
(4-(3-(4-fluorophenyl)ureido)benzenesulfonamide | 4...)Show InChI InChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| MMDB Article PubMed
| 960 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | 3D Structure (docked) |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50515525
(CHEMBL4569133)Show SMILES CCOC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(OC)cc1C(O)=O Show InChI InChI=1S/C26H20N2O8/c1-3-36-26(34)14-4-7-16(8-5-14)28-23(30)18-10-6-15(12-19(18)24(28)31)22(29)27-21-11-9-17(35-2)13-20(21)25(32)33/h4-13H,3H2,1-2H3,(H,27,29)(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 1.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA12 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50334354
(4-(3-(4-fluorophenyl)ureido)benzenesulfonamide | 4...)Show InChI InChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 5.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA1 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50515520
(CHEMBL4572128)Show SMILES OC(=O)c1cc(Cl)ccc1NC(=O)c1ccc2C(=O)N(C(=O)c2c1)c1ccccc1 Show InChI InChI=1S/C22H13ClN2O5/c23-13-7-9-18(17(11-13)22(29)30)24-19(26)12-6-8-15-16(10-12)21(28)25(20(15)27)14-4-2-1-3-5-14/h1-11H,(H,24,26)(H,29,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA9 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50515523
(CHEMBL4442193)Show SMILES OC(=O)c1ccc(cc1)N1C(=O)c2ccc(cc2C1=O)C(=O)Nc1ccc(Cl)cc1C(O)=O Show InChI InChI=1S/C23H13ClN2O7/c24-13-4-8-18(17(10-13)23(32)33)25-19(27)12-3-7-15-16(9-12)21(29)26(20(15)28)14-5-1-11(2-6-14)22(30)31/h1-10H,(H,25,27)(H,30,31)(H,32,33) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 7.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
King Saud University
Curated by ChEMBL
| Assay Description Inhibition of recombinant human CA2 preincubated for 15 mins by phenol red dye-based stopped-flow CO2 hydration assay |
Eur J Med Chem 181: (2019)
Article DOI: 10.1016/j.ejmech.2019.111573 BindingDB Entry DOI: 10.7270/Q2G1646X |
More data for this Ligand-Target Pair | |