BDBM71818 MLS000088651::N-[4-[[(E)-3-keto-4,4-dimethyl-pent-1-enyl]amino]phenyl]acetamide::N-[4-[[(E)-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]amino]phenyl]ethanamide::N-[4-[[(E)-4,4-dimethyl-3-oxopent-1-enyl]amino]phenyl]acetamide::N-{4-[(4,4-dimethyl-3-oxo-1-penten-1-yl)amino]phenyl}acetamide::SMR000072658::cid_2190180

SMILES Cc1cccc(-c2ccn(-c3cc(N4CCOCC4)n4nc(C(=O)N[C@@H]5CCN(C)C5)cc4n3)n2)c1

InChI Key InChIKey=OHYQSASLYKJMPM-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 71818   

Target1-phosphatidylinositol 3-phosphate 5-kinase(Human)
Verge Analytics

US Patent
LigandChemical structure of BindingDB Monomer ID 71818BDBM71818(N-[(3R)-1-methylpyrrolidin-3-yl]-7- morpholino-5-[...)
Affinity DataIC50: 112nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2026
Entry Details
US Patent