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BDBM302325 US9598415, 237

SMILES: CCS(=O)(=O)c1ccc(CNc2nc3cnc(nc3n(CC3CC3)c2=O)-c2c(C)ncnc2C2CC2)nc1

InChI Key: InChIKey=BWQQALPTRBNCQN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 302325   
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 (RORC)


(Homo sapiens (Human))
BDBM302325
PNG
(US9598415, 237)
Show SMILES CCS(=O)(=O)c1ccc(CNc2nc3cnc(nc3n(CC3CC3)c2=O)-c2c(C)ncnc2C2CC2)nc1
Show InChI InChI=1S/C26H28N8O3S/c1-3-38(36,37)19-9-8-18(27-11-19)10-28-24-26(35)34(13-16-4-5-16)25-20(32-24)12-29-23(33-25)21-15(2)30-14-31-22(21)17-6-7-17/h8-9,11-12,14,16-17H,3-7,10,13H2,1-2H3,(H,28,32)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 265n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
A nuclear receptor transactivation assay is performed to quantitate the ability of test compounds to inhibit RORγ transactivation of a luciferas...


US Patent US9598415 (2017)


BindingDB Entry DOI: 10.7270/Q2TQ63MW
More data for this
Ligand-Target Pair