Found 5 hits of Enzyme Inhibition Constant Data 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 |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50340957
(8-nitro-2-(2,3,4-trihydroxyphenyl)naphthalene-1,4-...)Show SMILES Oc1ccc(C2=CC(=O)c3cccc(c3C2=O)[N+]([O-])=O)c(O)c1O |t:5| Show InChI InChI=1S/C16H9NO7/c18-11-5-4-7(15(21)16(11)22)9-6-12(19)8-2-1-3-10(17(23)24)13(8)14(9)20/h1-6,18,21-22H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of Aurora A |
Bioorg Med Chem Lett 21: 2079-82 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.001 BindingDB Entry DOI: 10.7270/Q2ZW1M77 |
More data for this Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50340956
(5,8-dihydroxy-2-(2,3,4-trihydroxyphenyl)naphthalen...)Show SMILES Oc1ccc(C2=CC(=O)c3c(O)ccc(O)c3C2=O)c(O)c1O |t:5| Show InChI InChI=1S/C16H10O7/c17-8-3-4-9(18)13-12(8)11(20)5-7(14(13)21)6-1-2-10(19)16(23)15(6)22/h1-5,17-19,22-23H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of Aurora A |
Bioorg Med Chem Lett 21: 2079-82 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.001 BindingDB Entry DOI: 10.7270/Q2ZW1M77 |
More data for this Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50340955
(2-(2,4-dihydroxyphenyl)-8-hydroxy-1,4-naphthoquino...)Show SMILES Oc1ccc(C2=CC(=O)c3c(O)cccc3C2=O)c(O)c1 |t:5| Show InChI InChI=1S/C16H10O5/c17-8-4-5-9(13(19)6-8)11-7-14(20)15-10(16(11)21)2-1-3-12(15)18/h1-7,17-19H | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of Aurora A |
Bioorg Med Chem Lett 21: 2079-82 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.001 BindingDB Entry DOI: 10.7270/Q2ZW1M77 |
More data for this Ligand-Target Pair | |
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
(Homo sapiens (Human)) | BDBM50340955
(2-(2,4-dihydroxyphenyl)-8-hydroxy-1,4-naphthoquino...)Show SMILES Oc1ccc(C2=CC(=O)c3c(O)cccc3C2=O)c(O)c1 |t:5| Show InChI InChI=1S/C16H10O5/c17-8-4-5-9(13(19)6-8)11-7-14(20)15-10(16(11)21)2-1-3-12(15)18/h1-7,17-19H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of DYRK1a |
Bioorg Med Chem Lett 21: 2079-82 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.001 BindingDB Entry DOI: 10.7270/Q2ZW1M77 |
More data for this Ligand-Target Pair | |
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
(Homo sapiens (Human)) | BDBM50340956
(5,8-dihydroxy-2-(2,3,4-trihydroxyphenyl)naphthalen...)Show SMILES Oc1ccc(C2=CC(=O)c3c(O)ccc(O)c3C2=O)c(O)c1O |t:5| Show InChI InChI=1S/C16H10O7/c17-8-3-4-9(18)13-12(8)11(20)5-7(14(13)21)6-1-2-10(19)16(23)15(6)22/h1-5,17-19,22-23H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Padova
Curated by ChEMBL
| Assay Description Inhibition of DYRK1a |
Bioorg Med Chem Lett 21: 2079-82 (2011)
Article DOI: 10.1016/j.bmcl.2011.02.001 BindingDB Entry DOI: 10.7270/Q2ZW1M77 |
More data for this Ligand-Target Pair | |