Found 8 hits for monomerid = 50532435 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)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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 |
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)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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 |
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 2
(Homo sapiens (Human)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 83 | 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)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 83 | 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 9
(Homo sapiens (Human)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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 |
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)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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 |
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 1
(Homo sapiens (Human)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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)) | BDBM50532435
(CHEMBL4476084)Show SMILES O=C(Nc1ccc2c(c1)C(=O)NS2(=O)=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C20H14N2O4S/c23-19(15-8-6-14(7-9-15)13-4-2-1-3-5-13)21-16-10-11-18-17(12-16)20(24)22-27(18,25)26/h1-12H,(H,21,23)(H,22,24) | 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 | |