BDBM783337 2,2''-((3R,3''R,6R,6''R)- (((2S,2''S)-((1,3- phenylenebis(oxy))bis (methylene))bis (morpholine-2,4- diyl))bis(methylene)) bis(3-methylpiperazine- 6,1-diyl))bis(1-(6-(4- fluorobenzyl)-3,3- dimethyl-2,3-dihydro- 1H-pyrrolo[3,2- b]pyridin-1-yl)ethan-1- one)::US20250326771, Compound 145

SMILES C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccc(F)cc4)cc32)[C@@H](CN2CCO[C@H](COc3cccc(OC[C@@H]4CN(C[C@H]5CN[C@H](C)CN5CC(=O)N5CC(C)(C)c6ncc(Cc7ccc(F)cc7)cc65)CCO4)c3)C2)CN1

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 783337   

TargetBaculoviral IAP repeat-containing protein 3 [255-322](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 15.8nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent

TargetBaculoviral IAP repeat-containing protein 2 [269-336](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 15.8nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent

TargetE3 ubiquitin-protein ligase XIAP [265-330](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 282nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent

TargetBaculoviral IAP repeat-containing protein 2 [184-250](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 8.16E+3nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent

TargetE3 ubiquitin-protein ligase XIAP [163-230](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 3.57E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent

TargetBaculoviral IAP repeat-containing protein 3 [169-235](Human)
Viiv Healthcare

US Patent
LigandPNGBDBM783337(2,2'-((3R,3'R,6R,6'R)- (((2S,2'S)-((1,3- phenylene...)
Affinity DataIC50: 3.57E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
2/11/2026
Entry Details US Patent