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BDBM302261 US9598415, 173

SMILES: CCc1ncnc(C2CC2)c1-c1ncc2nc(NCc3ccc(cn3)S(=O)(=O)CC)c(=O)n(CC)c2n1

InChI Key: InChIKey=ZZZFGTYXWBRUKM-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 302261   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM302261
PNG
(US9598415, 173)
Show SMILES CCc1ncnc(C2CC2)c1-c1ncc2nc(NCc3ccc(cn3)S(=O)(=O)CC)c(=O)n(CC)c2n1
Show InChI InChI=1S/C25H28N8O3S/c1-4-18-20(21(15-7-8-15)30-14-29-18)22-28-13-19-24(32-22)33(5-2)25(34)23(31-19)27-11-16-9-10-17(12-26-16)37(35,36)6-3/h9-10,12-15H,4-8,11H2,1-3H3,(H,27,31)
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PC cid
PC sid
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US Patent
n/an/a 690n/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