BDBM438836 1'-[1-(4- Cyanophenyl)ethyl]- 5,5- spirocyclopropane-N- [(4- ethylsulfonylphenyl) methyl]spiro[4H- thieno[2,3-c]pyran- 7,4'-piperidine]-2- carboxamide isomer 1::US10603320, Example 8

SMILES CCS(=O)(=O)c1ccc(CNC(=O)c2cc3CC4(CC4)OC4(CCN(CC4)C(C)c4ccc(cc4)C#N)c3s2)cc1

InChI Key InChIKey=XBYJPWLUKRQKCU-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 438836   

TargetNuclear receptor ROR-gamma(Homo sapiens (Human))
Eli Lilly

US Patent
LigandPNGBDBM438836(1'-[1-(4- Cyanophenyl)ethyl]- 5,5- spirocyclopropa...)
Affinity DataKi:  6nMAssay Description:His-tagged human RAR-related orphan receptor alpha (hRORa), human RAR-related orphan receptor beta (hRORb), and human RAR-related orphan receptor gam...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetRAR related orphan receptor B isoform 1(Human)
Eli Lilly

US Patent
LigandPNGBDBM438836(1'-[1-(4- Cyanophenyl)ethyl]- 5,5- spirocyclopropa...)
Affinity DataKi: >1.25E+4nMAssay Description:His-tagged human RAR-related orphan receptor alpha (hRORa), human RAR-related orphan receptor beta (hRORb), and human RAR-related orphan receptor gam...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetNuclear receptor ROR-alpha(Homo sapiens (Human))
Eli Lilly

US Patent
LigandPNGBDBM438836(1'-[1-(4- Cyanophenyl)ethyl]- 5,5- spirocyclopropa...)
Affinity DataKi: >2.04E+4nMAssay Description:His-tagged human RAR-related orphan receptor alpha (hRORa), human RAR-related orphan receptor beta (hRORb), and human RAR-related orphan receptor gam...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent