BDBM77576 1-cyclopropyl-7-[3-(dimethylamino)propylamino]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid ethyl ester::1-cyclopropyl-7-[3-(dimethylamino)propylamino]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester::MLS001178662::SMR000476195::cid_1716469::ethyl 1-cyclopropyl-7-[3-(dimethylamino)propylamino]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylate::ethyl 1-cyclopropyl-7-[3-(dimethylamino)propylamino]-6,8-difluoro-4-oxoquinoline-3-carboxylate::ethyl 1-cyclopropyl-7-{[3-(dimethylamino)propyl]amino}-6,8-difluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate

SMILES O=C1CCCc2c1sc(Nc1ccc(I)cc1F)c2C(=O)NOC[C@H](O)CO

InChI Key InChIKey=MEEURINVDSNERE-UHFFFAOYSA-N

Data  1 IC50

  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 = 77576   

TargetMitogen-activated protein kinase kinase kinase 1(Human)
Nflection Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 77576BDBM77576(US20250387379, Compound 4.030)
Affinity DataIC50: 150nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent