BDBM50539805 CHEMBL4644032::US11840533, Compound 72

SMILES Cn1cc(-c2cc(c3ccn(c3c2)C(C)(c2ccccn2)c2ccccn2)C(C)(C)O)c2cc[nH]c(=O)c12

InChI Key InChIKey=NWFSSABGWKHOTN-UHFFFAOYSA-N

Data  2 KI  2 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50539805   

TargetBromodomain-containing protein 4(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50539805(CHEMBL4644032 | US11840533, Compound 72)
Affinity DataIC50: 40nMAssay Description:Displacement of APC-labeled biotinylated-avidin from Euphorium-chelated recombinant human BRD4 bromodomain 1 expressed in Escherichia coli preincubat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetBromodomain-containing protein 4(Human)
University of Illinois At Chicago

Curated by ChEMBL
LigandPNGBDBM50539805(CHEMBL4644032 | US11840533, Compound 72)
Affinity DataIC50: 220nMAssay Description:Displacement of APC-labeled biotinylated-avidin from Euphorium-chelated recombinant human BRD4 bromodomain 2 expressed in Escherichia coli preincubat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed
TargetBromodomain-containing protein 4 [75-147](Human)
University of Illinois

US Patent
LigandPNGBDBM50539805(CHEMBL4644032 | US11840533, Compound 72)
Affinity DataKi: <10nMAssay Description:The BRD4 bromodomain 1 and/or 2 binding activity were measured by using the Cayman BRD4 bromodomain 1 or 2 TR-FRET Assay Kit (Item. No. 600520, 60053...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/2/2024
Entry Details
Go to US Patent

TargetBromodomain-containing protein 4 [368-440](Human)
University of Illinois

US Patent
LigandPNGBDBM50539805(CHEMBL4644032 | US11840533, Compound 72)
In Depth
Date in BDB:
2/2/2024
Entry Details
Go to US Patent