BDBM77518 5-(4-Isopropoxy-benzyl)-pyrimidine-2,4-diamine::5-[(4-propan-2-yloxyphenyl)methyl]pyrimidine-2,4-diamine::MLS000067598::SMR000115899::[2-amino-5-(4-isopropoxybenzyl)pyrimidin-4-yl]amine::cid_826184

SMILES CN1CCN(CCC(=O)Nc2ccc3c(=O)n(CC4(O)CCN(C(=O)C(CCCNC(=O)c5ccc6c(Cl)cc(-c7ccccc7)nc6c5)Cc5ccccc5)CC4)cnc3c2)CC1

InChI Key InChIKey=QELIXOYLEJDYGT-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 = 77518   

TargetUbiquitin carboxyl-terminal hydrolase 7(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 77518BDBM77518(US12503453, Compound Table3.15 | US12503453, Compo...)
Affinity DataIC50: 550nMAssay 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:
5/4/2026
Entry Details
US Patent