Found 5 hits for monomerid = 50167423 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)) | BDBM50167423
(4-((6-methyl-4-oxo-4H-chromen-3-yl)methyleneamino)...)Show SMILES Cc1ccc2occ(\C=N\c3cc(c(cc3S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F)c(=O)c2c1 Show InChI InChI=1S/C18H14F3N3O6S2/c1-9-2-3-14-11(4-9)17(25)10(8-30-14)7-24-13-5-12(18(19,20)21)15(31(22,26)27)6-16(13)32(23,28)29/h2-8H,1H3,(H2,22,26,27)(H2,23,28,29)/b24-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 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)) | BDBM50167423
(4-((6-methyl-4-oxo-4H-chromen-3-yl)methyleneamino)...)Show SMILES Cc1ccc2occ(\C=N\c3cc(c(cc3S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F)c(=O)c2c1 Show InChI InChI=1S/C18H14F3N3O6S2/c1-9-2-3-14-11(4-9)17(25)10(8-30-14)7-24-13-5-12(18(19,20)21)15(31(22,26)27)6-16(13)32(23,28)29/h2-8H,1H3,(H2,22,26,27)(H2,23,28,29)/b24-7+ | 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
| 32 | 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)) | BDBM50167423
(4-((6-methyl-4-oxo-4H-chromen-3-yl)methyleneamino)...)Show SMILES Cc1ccc2occ(\C=N\c3cc(c(cc3S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F)c(=O)c2c1 Show InChI InChI=1S/C18H14F3N3O6S2/c1-9-2-3-14-11(4-9)17(25)10(8-30-14)7-24-13-5-12(18(19,20)21)15(31(22,26)27)6-16(13)32(23,28)29/h2-8H,1H3,(H2,22,26,27)(H2,23,28,29)/b24-7+ | 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
| 85 | 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)) | BDBM50167423
(4-((6-methyl-4-oxo-4H-chromen-3-yl)methyleneamino)...)Show SMILES Cc1ccc2occ(\C=N\c3cc(c(cc3S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F)c(=O)c2c1 Show InChI InChI=1S/C18H14F3N3O6S2/c1-9-2-3-14-11(4-9)17(25)10(8-30-14)7-24-13-5-12(18(19,20)21)15(31(22,26)27)6-16(13)32(23,28)29/h2-8H,1H3,(H2,22,26,27)(H2,23,28,29)/b24-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 133 | 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)) | BDBM50167423
(4-((6-methyl-4-oxo-4H-chromen-3-yl)methyleneamino)...)Show SMILES Cc1ccc2occ(\C=N\c3cc(c(cc3S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F)c(=O)c2c1 Show InChI InChI=1S/C18H14F3N3O6S2/c1-9-2-3-14-11(4-9)17(25)10(8-30-14)7-24-13-5-12(18(19,20)21)15(31(22,26)27)6-16(13)32(23,28)29/h2-8H,1H3,(H2,22,26,27)(H2,23,28,29)/b24-7+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.33E+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 | |