BDBM50119442 6,9,18,24,33-Pentaisobutyl-3,21,30-triisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31undecaaza-cyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone::cyclo-[MeLeu-Val-MeGly-MeLeu-Val-MeLeu-Ala-D-Ala-MeLeu-MeLeu-MeVal]6,9,18,24,33-Pentaisobutyl-3,21,30-triisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31undecaaza-cyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone

SMILES CC(C)C[C@H]1N(C)C(=O)CN(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)C(C)NC(=O)[C@@H](CC(C)C)N(C)C(=O)C(NC1=O)C(C)C)C(C)C

InChI Key InChIKey=WGLJIVGIBDNIIT-ZJVUSZPVSA-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 = 50119442   

TargetATP-dependent translocase ABCB1(Homo sapiens (Human))
Strasbourg 1 University

Curated by ChEMBL
LigandPNGBDBM50119442(6,9,18,24,33-Pentaisobutyl-3,21,30-triisopropyl-1,...)
Affinity DataIC50:  7.00E+3nMAssay Description:Inhibitory activity against Human MDR1 P-Glycoprotein ABC Transporter using leukemia CEM cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed