BDBM689513 US12054475, Compound 49::US12054475, Compound 9

SMILES CCn1cncc1C(=O)Nc1ccc2NC(=O)CCc2c1

InChI Key InChIKey=RVHUOWCQIVMROI-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 689513   

TargetRetinal dehydrogenase 2(Human)
Kayothera

US Patent
LigandPNGBDBM689513(US12054475, Compound 49 | US12054475, Compound 9)
Affinity DataIC50: 587nMAssay Description:Recombinant protein extraction: pET-Aldh1a2 transformed BL21-DE3 cultures induced at 20° C. for 19 h with 0.3 mM IPTG rocking. Cultures were spun at ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2024
Entry Details
Go to US Patent

TargetRetinal dehydrogenase 2(Mouse)
Kayothera

US Patent
LigandPNGBDBM689513(US12054475, Compound 49 | US12054475, Compound 9)
Affinity DataIC50: 1.11E+3nMAssay Description:Recombinant protein extraction: pET-Aldh1a2 transformed BL21-DE3 cultures induced at 20° C. for 19 h with 0.3 mM IPTG rocking. Cultures were spun at ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2024
Entry Details
Go to US Patent

TargetRetinal dehydrogenase 2(Human)
Kayothera

US Patent
LigandPNGBDBM689513(US12054475, Compound 49 | US12054475, Compound 9)
Affinity DataIC50: 1.00E+4nMAssay Description:Recombinant protein extraction: pET-Aldh1a2 transformed BL21-DE3 cultures induced at 20° C. for 19 h with 0.3 mM IPTG rocking. Cultures were spun at ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2024
Entry Details
Go to US Patent

TargetRetinal dehydrogenase 2(Mouse)
Kayothera

US Patent
LigandPNGBDBM689513(US12054475, Compound 49 | US12054475, Compound 9)
Affinity DataIC50: 1.00E+4nMAssay Description:Recombinant protein extraction: pET-Aldh1a2 transformed BL21-DE3 cultures induced at 20° C. for 19 h with 0.3 mM IPTG rocking. Cultures were spun at ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2024
Entry Details
Go to US Patent