BDBM50394169 CHEMBL2158851
SMILES: N#Cc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
InChI Key: InChIKey=NXSQPOJZYAFZHL-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50394169 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 SMG1
(Homo sapiens (Human)) | BDBM50394169
(CHEMBL2158851)Show SMILES N#Cc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1 Show InChI InChI=1S/C20H18N6O/c21-14-15-2-1-3-17(12-15)24-20-23-7-5-18(25-20)16-4-6-22-19(13-16)26-8-10-27-11-9-26/h1-7,12-13H,8-11H2,(H,23,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant SMG1 expressed in HEK293 cells using GST-tagged p53 as substrate after 1 hr by DELFIA assay |
Bioorg Med Chem Lett 22: 6636-41 (2012)
Article DOI: 10.1016/j.bmcl.2012.08.107
BindingDB Entry DOI: 10.7270/Q2TB181N |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human)) | BDBM50394169
(CHEMBL2158851)Show SMILES N#Cc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1 Show InChI InChI=1S/C20H18N6O/c21-14-15-2-1-3-17(12-15)24-20-23-7-5-18(25-20)16-4-6-22-19(13-16)26-8-10-27-11-9-26/h1-7,12-13H,8-11H2,(H,23,24,25) | 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 | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of mTOR |
Bioorg Med Chem Lett 22: 6636-41 (2012)
Article DOI: 10.1016/j.bmcl.2012.08.107
BindingDB Entry DOI: 10.7270/Q2TB181N |
More data for this
Ligand-Target Pair | |
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