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BDBM256383 US9487490, 6C

SMILES: CC1CC(=CC(O)C1C(O)=O)c1nn(C(=O)c2c(Cl)cccc2C(F)(F)F)c2cccc(F)c12

InChI Key: InChIKey=DTFLTTVMFQVAJF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 256383   
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
Isoform 2 of Nuclear receptor ROR-gamma


(Homo sapiens (Human))
BDBM256383
PNG
(US9487490, 6C)
Show SMILES CC1CC(=CC(O)C1C(O)=O)c1nn(C(=O)c2c(Cl)cccc2C(F)(F)F)c2cccc(F)c12 |c:3|
Show InChI InChI=1S/C23H17ClF4N2O4/c1-10-8-11(9-16(31)17(10)22(33)34)20-19-14(25)6-3-7-15(19)30(29-20)21(32)18-12(23(26,27)28)4-2-5-13(18)24/h2-7,9-10,16-17,31H,8H2,1H3,(H,33,34)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/a7.04



Merck Sharp & Dohme Corp.

US Patent


Assay 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...


US Patent US9487490 (2016)


BindingDB Entry DOI: 10.7270/Q2GQ6WQN
More data for this
Ligand-Target Pair