BDBM605145 (R)-2-{[(2S,5S)-5-((S)-2-Acetylamino-3- methyl-butyrylamino)-4-oxo- 1,2,4,5,6,7-hexahydro-azepino[3,2,1- hi]indole-2-carbonyl]-amino}- propionicacid methyl ester::US11667645, Compound C088

SMILES COC(=O)[C@@H](C)NC(=O)[C@@H]1Cc2cccc3CC[C@H](NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N1c23

InChI Key InChIKey=XARDHIZBPKZJPO-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 = 605145   

TargetGranzyme B(Human)
Cytosite Biopharma

US Patent
LigandPNGBDBM605145((R)-2-{[(2S,5S)-5-((S)-2-Acetylamino-3- methyl-but...)
Affinity DataIC50: 5.00E+3nMAssay Description:Buffer pH7.4: Prepare 1 (M) KH2PO4 and 1 (M) K2HPO4. Titrate 1(M) K2HPO4 with 1 (M) KH2PO4 to obtain pH 7.40. Dilute this buffer 10 fold in Water (30...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2023
Entry Details
US Patent