Compound name
BAY-179
Protein family
Dehydrogenase
Target name
NDUFS2
Affinity on-target cellular (nM)
79
CG-Set
Other targets
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0000752a
SMILES
N1(CC2=NC3=C(C=CC=N3)N2)CCC(c4scc(c(c5)oc6c5cccc6)n4)CC1
InChIKey
JOCPQSJABURDDD-UHFFFAOYSA-N
NCBI gene ID
4720
UniProt ID
O75306
Synonyms
CI-49, MC1DN6
Mode of action
Inhibitor
Negative control
BAY-070
Affinity on-target cellular definition
IC50
Affinity on-target cellular assay type
Cellular activity assay (measurement of ATP levels in presence of complex II substrate succinate in H1299 cells)
Affinity on-target cellular relation
=
Selectivity remarks
Biochemical bovine OxPhos activity assay: >30 µM for Complex 2, 3, 4 and 5; Screened against 45 GPCR targets (PDSP screen) at 10 µM, closest targets:Ki(HTR2B) = 558.19 nM, Ki(TMEM97) = 1118.32 nM, Ki(SIGMAR1) = 1179.84 nM, Ki(ADRA2C) = 3499.92 nM; Screened in Eurofins-CEREP, GPCR panel at 10 µM, closest target as % inhibition: HTR2B (73.5%); Selectivity > 500 fold against numerous kinases tested;
Selectivity Source Knowledge
https://doi.org/10.1021/acsmedchemlett.1c00666
https://www.sgc-ffm.uni-frankfurt.de/#!specificprobeoverview/BAY-179