null
SMILES: COc1ccc(cc1)-c1n[nH]c(=O)c2[nH]c3ccc(OC)cc3c12
InChI Key: InChIKey=IPDBYSDTJNQVBN-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50028101 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 |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50028101
(CHEMBL3338886)Show SMILES COc1ccc(cc1)-c1n[nH]c(=O)c2[nH]c3ccc(OC)cc3c12 Show InChI InChI=1S/C18H15N3O3/c1-23-11-5-3-10(4-6-11)16-15-13-9-12(24-2)7-8-14(13)19-17(15)18(22)21-20-16/h3-9,19H,1-2H3,(H,21,22) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description Inhibition of p110alpha (unknown origin) |
Bioorg Med Chem Lett 24: 5037-40 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.017 BindingDB Entry DOI: 10.7270/Q27H1M51 |
More data for this Ligand-Target Pair | |
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
(Homo sapiens (Human)) | BDBM50028101
(CHEMBL3338886)Show SMILES COc1ccc(cc1)-c1n[nH]c(=O)c2[nH]c3ccc(OC)cc3c12 Show InChI InChI=1S/C18H15N3O3/c1-23-11-5-3-10(4-6-11)16-15-13-9-12(24-2)7-8-14(13)19-17(15)18(22)21-20-16/h3-9,19H,1-2H3,(H,21,22) | 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 | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description Inhibition of DYRK1A (unknown origin) |
Bioorg Med Chem Lett 24: 5037-40 (2014)
Article DOI: 10.1016/j.bmcl.2014.09.017 BindingDB Entry DOI: 10.7270/Q27H1M51 |
More data for this Ligand-Target Pair | |