BDBM352646 (S)-neopentyl (2-(2- (methylamino)-2- oxoethyl)-4-((3- (trifluoromethyl)phenyl) sulfonyl)-3,4- dihydro-2H- benzo[b][1,4]oxazin-6- yl)carbamate::US10745364, Example 37AH::US9809561, 37AH

SMILES CNC(=O)C[C@H]1CN(c2cc(NC(=O)OCC(C)(C)C)ccc2O1)S(=O)(=O)c1cccc(c1)C(F)(F)F

InChI Key InChIKey=KYTGUTYWMQANRN-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 352646   

TargetNuclear receptor ROR-gamma(Human)
Lycera

US Patent
LigandPNGBDBM352646(US9809561, 37AH | (S)-neopentyl (2-(2- (methylamin...)
Affinity DataIC50: 2.11nMAssay Description:HIS-tagged RORγ-LBD protein was recombinantly expressed in Escherichia coli. The RORγ-LBD protein was purified by Ni2+-affinity resin. Puri...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/20/2019
Entry Details
US Patent

TargetNuclear receptor ROR-gamma(Human)
Lycera

US Patent
LigandPNGBDBM352646(US9809561, 37AH | (S)-neopentyl (2-(2- (methylamin...)
Affinity DataIC50: 2.11nMAssay Description:To identify novel antagonists of RORgammaT, an assay was developed which employs the interaction of RORgammaT with its co-activator peptide SRC1_2. T...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2021
Entry Details
US Patent

TargetNuclear receptor ROR-gamma(Human)
Lycera

US Patent
LigandPNGBDBM352646(US9809561, 37AH | (S)-neopentyl (2-(2- (methylamin...)
Affinity DataIC50: 2.11nMAssay Description:The compounds of the invention inhibit RORgammaT activity. Activation of RORgammaT activity can be measured using, e.g., a biochemical TR-FRET assay....More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2019
Entry Details
US Patent