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BDBM341962 US9771320, Example 196::US9771320, Example 197

SMILES: Fc1ccc(cc1)S(=O)(=O)C1(CCC(C1)NC(=O)C1CCOCC1)c1ccc(cc1)C(OCc1c(F)cccc1F)(C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=VYRNTFQUERSREA-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 341962   
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))
BDBM341962
PNG
(US9771320, Example 196 | US9771320, Example 197)
Show SMILES Fc1ccc(cc1)S(=O)(=O)C1(CCC(C1)NC(=O)C1CCOCC1)c1ccc(cc1)C(OCc1c(F)cccc1F)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C33H30F9NO5S/c34-23-8-10-25(11-9-23)49(45,46)30(15-12-24(18-30)43-29(44)20-13-16-47-17-14-20)21-4-6-22(7-5-21)31(32(37,38)39,33(40,41)42)48-19-26-27(35)2-1-3-28(26)36/h1-11,20,24H,12-19H2,(H,43,44)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 43n/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
Nuclear receptor ROR-gamma


(Homo sapiens (Human))
BDBM341962
PNG
(US9771320, Example 196 | US9771320, Example 197)
Show SMILES Fc1ccc(cc1)S(=O)(=O)C1(CCC(C1)NC(=O)C1CCOCC1)c1ccc(cc1)C(OCc1c(F)cccc1F)(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C33H30F9NO5S/c34-23-8-10-25(11-9-23)49(45,46)30(15-12-24(18-30)43-29(44)20-13-16-47-17-14-20)21-4-6-22(7-5-21)31(32(37,38)39,33(40,41)42)48-19-26-27(35)2-1-3-28(26)36/h1-11,20,24H,12-19H2,(H,43,44)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 356n/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