BDBM548243 (5aS,8aR)-2-((R)-3-methylmorpholino)-5,5a,6,7,8,8a-hexahydro-4H-cyclopenta[e]pyrazolo[1,5-a]pyrazin-4-one::WO2022093820, Compound 9

SMILES C[C@@H]1COCCN1c2cc3n(n2)[C@@H]4CCC[C@@H]4NC3=O

InChI Key InChIKey=LQBRZKIUSVUXJP-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 548243   

TargetPhosphatidylinositol 3-kinase catalytic subunit type 3(Human)
Genentech

WIPO

LigandBDBM548243((5aS,8aR)-2-((R)-3-methylmorpholino)-5,5a,6,7,8,8a...)Copy SMILESCopy InChI

Affinity DataIC50: 83nMAssay Description: [0194] Experimental compound in DMSO was dispensed to a 384-well microplate via acoustic dispenser at 50 nl per well. At 2.5 µl per well, an enzyme ...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPurchasePC cidPC sidPDBSimilars

In Depth
Date in BDB:
7/21/2022
Entry Details
Copy Entry DOIWIPO WO2022093820
PDB3D Structure (crystal)
Copy Rxn URL

TargetPhosphatidylinositol 3-kinase catalytic subunit type 3(Human)
Genentech

WIPO

LigandBDBM548243((5aS,8aR)-2-((R)-3-methylmorpholino)-5,5a,6,7,8,8a...)Copy SMILESCopy InChI

Affinity DataIC50: 83nMAssay Description:Inhibition of human wild type N-terminal GST tagged VPS34 (1 to 887 end) expressed in baculovirus infected Sf21 insect cells using PI and Phosphatidy...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPurchasePC cidPC sidPDBSimilars

In Depth
Date in BDB:
6/22/2023
Entry Details
Copy Entry DOIPubMedPDB3D Structure (crystal)
Copy Rxn URL