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BDBM341834 US9771320, Example 68

SMILES: Nc1cccc(COC(c2ccc(cc2)C2(CCCC2)S(=O)(=O)c2ccc(F)cc2)(C(F)(F)F)C(F)(F)F)c1

InChI Key: InChIKey=AHDXARZCOWVXNY-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 341834   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Nuclear receptor ROR-gamma


(Homo sapiens (Human))
BDBM341834
PNG
(US9771320, Example 68)
Show SMILES Nc1cccc(COC(c2ccc(cc2)C2(CCCC2)S(=O)(=O)c2ccc(F)cc2)(C(F)(F)F)C(F)(F)F)c1
Show InChI InChI=1S/C27H24F7NO3S/c28-21-10-12-23(13-11-21)39(36,37)24(14-1-2-15-24)19-6-8-20(9-7-19)25(26(29,30)31,27(32,33)34)38-17-18-4-3-5-22(35)16-18/h3-13,16H,1-2,14-15,17,35H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 32n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The binding of potential ligands to RORγ is measured by competition with [3H] 25-hydroxycholesterol (Perkin Elmer NET674250UC) using a scintilla...


US Patent US9771320 (2017)

More data for this
Ligand-Target Pair