BDBM50517159 CHEMBL4461170

SMILES Cc1cc(C)cc(Oc2nccc(n2)-c2c(nnn2C2CCNCC2)-c2ccc(F)cc2)c1

InChI Key InChIKey=REMWDXIRFCSNPZ-UHFFFAOYSA-N

Data  2 IC50  1 Kd

  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 = 50517159   

TargetMitogen-activated protein kinase 14(Human)
University of Minnesota Twin Cities

Curated by ChEMBL
LigandPNGBDBM50517159(CHEMBL4461170)
Affinity DataKd:  120nMAssay Description:Binding affinity to wild-type human full length p38-alpha (M1 to S360 residues) expressed in bacterial expression system by Kinomescan methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed
TargetBromodomain-containing protein 4(Human)
University of Minnesota Twin Cities

Curated by ChEMBL
LigandPNGBDBM50517159(CHEMBL4461170)
Affinity DataIC50: 2.70E+4nMAssay Description:Inhibition of biotinylated histone H4 peptide binding to BRD4 bromodomain 1 (44 to 168 residues) (unknown origin) after 60 mins by Alphascreen methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed
TargetBromodomain-containing protein 4(Human)
University of Minnesota Twin Cities

Curated by ChEMBL
LigandPNGBDBM50517159(CHEMBL4461170)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of BRD4 bromodomain 1 (unknown origin) expressed in Escherichia coli Bl21(DE3)-pRARE cells by fluorescence anisotropyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/22/2021
Entry Details Article
PubMed