Compound name
AMG 18
Protein family
Protein Kinase
Target name
ERN1
Affinity biochemical (nM)
5.9
Affinity on-target cellular (nM)
99
CG-Set
Kinase set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0001858aCl
SMILES
Cc1ccc2c(NS(=O)(=O)c3ccccc3Cl)cccc2c1Oc1ncccc1-c1ccnc(N[C@H]2CCCNC2)n1.Cl
InChIKey
XMWUCMFVDXDRDE-NRFANRHFSA-N
NCBI gene ID
2081
UniProt ID
O75460
Synonyms
IRE1, IRE1P
Mode of action
Allosteric Inhibitor
Affinity biochemical definition
IC50
Affinity biochemical assay type
Enzymatic assay (IRE1α∗ RNase activity assay)
Affinity Biochemical Source Knowledge
https://pubmed.ncbi.nlm.nih.gov/28380378/
Affinity biochemical relation
=
Affinity on-target cellular definition
IC50
Affinity on-target cellular assay type
XBP1-Luc cell assay (Bright-Glo Luciferase Assay System, Promega, using HT1080-CMV-XBP1-Luciferase cells)
Affinity on-target cellular source knowledge
https://pubs.acs.org/doi/10.1021/ml500315b
Affinity on-target cellular relation
=
Selectivity platform
Kinase panel (Reaction Biology)
Selectivity platform number of targets
365
Selectivity remarks
Screened at 1 µM, closest targets as % of enzymatic activity: ERN1(2.32%), ERN2(39.56%), JANK2(54.33%), full screening data available as supporting information; Screened at 1 µM against 100 kinases (DiscoveRX KINOMEscan), closest targets as % of control: HIPK1 (54%), full screening data available as supporting information, https://pubs.acs.org/doi/10.1021/ml500315b;
Selectivity Source Knowledge
https://pubmed.ncbi.nlm.nih.gov/28380378/
Selectivity Number of Off-targets
0