BDBM66896 MLS001031761::N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-5-keto-7a-methyl-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide::N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-7a-methyl-N-(2-methylpropyl)-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide::N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-7a-methyl-N-(2-methylpropyl)-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b]thiazole-3-carboxamide::N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-7a-methyl-N-(2-methylpropyl)-5-oxidanylidene-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide::SMR000714243::cid_24816584

SMILES N=C(N)NCCC[C@H](NC(=O)[C@@H](CCCCN)[C@]1(C(N)=O)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1)C(N)=O

InChI Key InChIKey=ZQVIGKUOUNEIGJ-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 66896   

TargetN-terminal Xaa-Pro-Lys N-methyltransferase 1(Human)
Purdue Research Foundation

US Patent
LigandChemical structure of BindingDB Monomer ID 66896BDBM66896((S)-((S)-6-amino-1-(((S)-1-amino-5-guanidino-1-oxo...)
Affinity DataIC50: 8.96E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2026
Entry Details
US Patent