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BDBM302227 US9598415, 139

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

InChI Key: InChIKey=JCKLXLWQPFIBFN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 302227   
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))
BDBM302227
PNG
(US9598415, 139)
Show SMILES CCS(=O)(=O)c1ccc(CNc2nc3cnc(nc3n(c2=O)C(C)(C)C)-c2c(C)ncnc2C2CC2)nc1
Show InChI InChI=1S/C26H30N8O3S/c1-6-38(36,37)18-10-9-17(27-12-18)11-28-23-25(35)34(26(3,4)5)24-19(32-23)13-29-22(33-24)20-15(2)30-14-31-21(20)16-7-8-16/h9-10,12-14,16H,6-8,11H2,1-5H3,(H,28,32)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 700n/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