BDBM50396318 CHEMBL2172633
SMILES: Cc1nc(Nc2ccc(nn2)N2CCOCC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
InChI Key: InChIKey=RWELDMOWSUFXDT-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50396318 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)) | BDBM50396318
(CHEMBL2172633)Show SMILES Cc1nc(Nc2ccc(nn2)N2CCOCC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12 Show InChI InChI=1S/C22H22N12O/c1-14-25-15(21-22(28-17-6-8-23-30-17)29-19-3-2-7-24-34(19)21)13-18(26-14)27-16-4-5-20(32-31-16)33-9-11-35-12-10-33/h2-8,13H,9-12H2,1H3,(H2,23,28,30)(H,25,26,27,31) | 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 | 35 | 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)) | BDBM50396318
(CHEMBL2172633)Show SMILES Cc1nc(Nc2ccc(nn2)N2CCOCC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12 Show InChI InChI=1S/C22H22N12O/c1-14-25-15(21-22(28-17-6-8-23-30-17)29-19-3-2-7-24-34(19)21)13-18(26-14)27-16-4-5-20(32-31-16)33-9-11-35-12-10-33/h2-8,13H,9-12H2,1H3,(H2,23,28,30)(H,25,26,27,31) | 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 | 256 | 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 | |
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