BDBM540820 (1-(3- methylphenyl)-1H- 1,2,3-triazol- 5-yl)methyl- (2alpha,3beta)-2,3- dihydroxyolean- 12-en-28-oate::US11266632, Compound 9

SMILES CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@@]34C)C2C1)C(=O)OCc1cnnn1-c1ccccc1

InChI Key InChIKey=OZSQPIWTUFAGNK-UHFFFAOYSA-N

Data  1 IC50

  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 = 540820   

TargetSpike glycoprotein(2019-nCoV)
King Abdulaziz University

US Patent
LigandPNGBDBM540820(US11266632, Compound 9 | (1-(3- methylphenyl)-1H- ...)
Affinity DataIC50: 1.32E+5nMAssay Description:The IC50 values for the tested compounds were determined as previously described [2, 3], with minor modifications. Briefly, in 96-well tissue culture...More data for this Ligand-Target Pair
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Date in BDB:
6/26/2022
Entry Details
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