Found 5 hits for monomerid = 50167404 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)) | BDBM50167404
(4-((4-oxo-4H-chromen-3-yl)methyleneamino)-6-(trifl...)Show SMILES NS(=O)(=O)c1cc(c(cc1\N=C\c1coc2ccccc2c1=O)C(F)(F)F)S(N)(=O)=O Show InChI InChI=1S/C17H12F3N3O6S2/c18-17(19,20)11-5-12(15(31(22,27)28)6-14(11)30(21,25)26)23-7-9-8-29-13-4-2-1-3-10(13)16(9)24/h1-8H,(H2,21,25,26)(H2,22,27,28)/b23-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ospedale San Lazzaro
Curated by ChEMBL
| Assay Description Inhibition constant against human carbonic anhydrase XII |
Bioorg Med Chem Lett 15: 3096-101 (2005)
Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50167404
(4-((4-oxo-4H-chromen-3-yl)methyleneamino)-6-(trifl...)Show SMILES NS(=O)(=O)c1cc(c(cc1\N=C\c1coc2ccccc2c1=O)C(F)(F)F)S(N)(=O)=O Show InChI InChI=1S/C17H12F3N3O6S2/c18-17(19,20)11-5-12(15(31(22,27)28)6-14(11)30(21,25)26)23-7-9-8-29-13-4-2-1-3-10(13)16(9)24/h1-8H,(H2,21,25,26)(H2,22,27,28)/b23-7+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ospedale San Lazzaro
Curated by ChEMBL
| Assay Description Inhibition constant against human carbonic anhydrase IX |
Bioorg Med Chem Lett 15: 3096-101 (2005)
Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50167404
(4-((4-oxo-4H-chromen-3-yl)methyleneamino)-6-(trifl...)Show SMILES NS(=O)(=O)c1cc(c(cc1\N=C\c1coc2ccccc2c1=O)C(F)(F)F)S(N)(=O)=O Show InChI InChI=1S/C17H12F3N3O6S2/c18-17(19,20)11-5-12(15(31(22,27)28)6-14(11)30(21,25)26)23-7-9-8-29-13-4-2-1-3-10(13)16(9)24/h1-8H,(H2,21,25,26)(H2,22,27,28)/b23-7+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 94 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ospedale San Lazzaro
Curated by ChEMBL
| Assay Description Inhibition constant against human carbonic anhydrase I |
Bioorg Med Chem Lett 15: 3096-101 (2005)
Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50167404
(4-((4-oxo-4H-chromen-3-yl)methyleneamino)-6-(trifl...)Show SMILES NS(=O)(=O)c1cc(c(cc1\N=C\c1coc2ccccc2c1=O)C(F)(F)F)S(N)(=O)=O Show InChI InChI=1S/C17H12F3N3O6S2/c18-17(19,20)11-5-12(15(31(22,27)28)6-14(11)30(21,25)26)23-7-9-8-29-13-4-2-1-3-10(13)16(9)24/h1-8H,(H2,21,25,26)(H2,22,27,28)/b23-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 102 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ospedale San Lazzaro
Curated by ChEMBL
| Assay Description Inhibition constant against human carbonic anhydrase II |
Bioorg Med Chem Lett 15: 3096-101 (2005)
Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50167404
(4-((4-oxo-4H-chromen-3-yl)methyleneamino)-6-(trifl...)Show SMILES NS(=O)(=O)c1cc(c(cc1\N=C\c1coc2ccccc2c1=O)C(F)(F)F)S(N)(=O)=O Show InChI InChI=1S/C17H12F3N3O6S2/c18-17(19,20)11-5-12(15(31(22,27)28)6-14(11)30(21,25)26)23-7-9-8-29-13-4-2-1-3-10(13)16(9)24/h1-8H,(H2,21,25,26)(H2,22,27,28)/b23-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.02E+11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Harran University
Curated by ChEMBL
| Assay Description Inhibition of carbonic anhydrase 2 assessed as inhibition of carbon dioxide hydration |
Eur J Med Chem 44: 3439-44 (2009)
Article DOI: 10.1016/j.ejmech.2009.02.016 BindingDB Entry DOI: 10.7270/Q26W9DWG |
More data for this Ligand-Target Pair | |