BDBM650698 (2R,3S,4aR,7aR)-N-(4-(dimethylamino)phenyl)-1-(2- fluoro-6-methylbenzoyl)-2-(4-((tetrahydro-2H-pyran-4- yl)amino)phenyl)octahydro-1H-cyclopenta[b]pyridine-3- carboxamide::US20240043439, Compound 94

SMILES CN(C)c1ccc(NC(=O)[C@H]2C[C@H]3CCC[C@H]3N([C@H]2c2ccc(NC3CCOCC3)cc2)C(=O)c2c(C)cccc2F)cc1

InChI Key InChIKey=CBSJIZQEFQUYNP-UHFFFAOYSA-N

Data  3 IC50

  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 = 650698   

TargetC5a anaphylatoxin chemotactic receptor 1(Human)
Kira Pharmaceuticals (Suzhou)

US Patent
LigandPNGBDBM650698((2R,3S,4aR,7aR)-N-(4-(dimethylamino)phenyl)-1-(2- ...)
Affinity DataIC50: 2.55E+3nMAssay Description:U937 cells were originally obtained from the American Type Culture Collection (ATCC) and transfected with human C5a receptor (C5aR). U937/C5aR cells ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent

TargetC5a anaphylatoxin chemotactic receptor 1(Human)
Kira Pharmaceuticals (Suzhou)

US Patent
LigandPNGBDBM650698((2R,3S,4aR,7aR)-N-(4-(dimethylamino)phenyl)-1-(2- ...)
Affinity DataIC50: 2.75E+4nMAssay Description:Migration assay was performed by using polycarbonate membrane with 3.0 m pore (Corning). U937/C5aR cells were collected and washed twice by PBS; cell...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent

TargetC5a anaphylatoxin chemotactic receptor 1(Human)
Kira Pharmaceuticals (Suzhou)

US Patent
LigandPNGBDBM650698((2R,3S,4aR,7aR)-N-(4-(dimethylamino)phenyl)-1-(2- ...)
Affinity DataIC50: 1.00E+5nMAssay Description:U937/C5aR cells or HEK293/C5aR cells were washed by PBS and suspended in growth media at the density of 1 106 cells/ml. Seed 2 cell suspension to the...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent