null
SMILES: COc1cnnc(Nc2cc(nc(C)n2)-c2c(Nc3ccn[nH]3)nc3cccnn23)c1
InChI Key: InChIKey=UNITWMRQPUTNPC-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50396316 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 |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50396316
(CHEMBL2172635)Show SMILES COc1cnnc(Nc2cc(nc(C)n2)-c2c(Nc3ccn[nH]3)nc3cccnn23)c1 Show InChI InChI=1S/C19H17N11O/c1-11-23-13(9-15(24-11)25-16-8-12(31-2)10-21-29-16)18-19(26-14-5-7-20-28-14)27-17-4-3-6-22-30(17)18/h3-10H,1-2H3,(H2,20,26,28)(H,23,24,25,29) | 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 | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of mTOR by LanthaScreen assay |
Bioorg Med Chem Lett 22: 4967-74 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.033 BindingDB Entry DOI: 10.7270/Q2BK1DHN |
More data for this Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50396316
(CHEMBL2172635)Show SMILES COc1cnnc(Nc2cc(nc(C)n2)-c2c(Nc3ccn[nH]3)nc3cccnn23)c1 Show InChI InChI=1S/C19H17N11O/c1-11-23-13(9-15(24-11)25-16-8-12(31-2)10-21-29-16)18-19(26-14-5-7-20-28-14)27-17-4-3-6-22-30(17)18/h3-10H,1-2H3,(H2,20,26,28)(H,23,24,25,29) | 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 | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of PI3Kalpha by AlphaScreen assay |
Bioorg Med Chem Lett 22: 4967-74 (2012)
Article DOI: 10.1016/j.bmcl.2012.06.033 BindingDB Entry DOI: 10.7270/Q2BK1DHN |
More data for this Ligand-Target Pair | |