Compound name
BAY-899
Protein family
GPCR
Target name
LHCGR
Affinity on-target cellular (nM)
185
CG-Set
GPCR set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0000240b
SMILES
O=C(Nc1cnc(Oc2ccc(F)cc2)nc1)N1CCc2ncccc2[C@@H]1c1ccc(F)cc1
InChIKey
VKQBTIMLSDGNLG-QHCPKHFHSA-N
NCBI gene ID
3973
UniProt ID
P22888
Synonyms
LHR, LCGR, LGR2, ULG5
Mode of action
Inhibitor
Negative control
BAY-897
Affinity on-target cellular definition
IC50
Affinity on-target cellular assay type
Cell-based assay (LH Antagonism)
Affinity on-target cellular relation
=
Selectivity platform
GPCR panel (Eurofins, Bayer)
Selectivity platform number of targets
25
Selectivity remarks
Screened at 10 µM, closest targets in the GPCR scan: Ki(SIGMAR1) = 1431.53 nM, Ki(TMEM97) = 2051.16 nM, Ki(OPRK1) = 7634.84 nM; hTSH antagonism: IC50 = 24 µM; hFSH antagonism: IC50 > 16 µM; Screened against 468 kinases (KinomeScan (DiscoverX)) at 1 µM, closest target as % of contr.: CDKL2 (33%)
Selectivity Source Knowledge
https://doi.org/10.1021/acs.jmedchem.9b01382
https://www.sgc-ffm.uni-frankfurt.de/#!specificprobeoverview/BAY-899
Selectivity Number of Off-targets
0