BDBM50468549 CHEMBL4291772

SMILES CCN1c2ccc(cc2N=C(C1=O)C)C(=O)N[C@@H](C)c3cnn(c3C)C

InChI Key InChIKey=ZHMKNBFQCHDNKP-UHFFFAOYSA-N

Data  3 Kd

PDB links: 1 PDB ID matches this monomer.

  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 3 hits for monomerid = 50468549   

TargetBromodomain-containing protein 4(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50468549(CHEMBL4291772)
Affinity DataKd: >1.00E+5nMAssay Description:Binding affinity to human partial length BRD4 BD1 (N44 to E168 residues) expressed in Escherichia coli BL21 after 1 hr by BROMOscan assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTranscription intermediary factor 1-alpha(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50468549(CHEMBL4291772)
Affinity DataKd: >1.00E+5nMAssay Description:Binding affinity to human partial length TRIM24-phd-bromo (P790 to P977 residues) expressed in Escherichia coli BL21 after 1 hr by BROMOscan assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetPeregrin(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50468549(CHEMBL4291772)
Affinity DataKd:  2.00E+4nMAssay Description:Binding affinity to human partial length BRPF1 (E627 to G740 residues) expressed in Escherichia coli BL21 after 1 hr by BROMOscan assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)