Found 8 hits for monomerid = 50532422 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | 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 |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | 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 |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 205 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 9 catalytic site preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 205 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 9 catalytic site preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 6.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 6.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50532422
(CHEMBL4469914)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C15H12N2O5S/c1-22-11-5-2-9(3-6-11)14(18)16-10-4-7-12-13(8-10)23(20,21)17-15(12)19/h2-8H,1H3,(H,16,18)(H,17,19) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Pisa
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
J Med Chem 59: 6547-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00616 |
More data for this Ligand-Target Pair | |