BDBM50511135 CHEMBL4457901

SMILES OC(=O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc2ccccc2c1

InChI Key InChIKey=NSEKHDVVZNMXDE-UHFFFAOYSA-N

Data  4 KI

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 4 hits for monomerid = 50511135   

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
National Institute of Chemistry

Curated by ChEMBL
LigandPNGBDBM50511135(CHEMBL4457901)
Affinity DataKi:  220nMAssay Description:Inhibition of N-terminal His6-tagged human Mcl1 expressed in Escherichia coli Rosetta2 DE3 by fluorescent labeled Flu-Bid peptide based fluorescence ...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetBcl-2-related protein A1(Human)
National Institute of Chemistry

Curated by ChEMBL
LigandPNGBDBM50511135(CHEMBL4457901)
Affinity DataKi:  570nMAssay Description:Inhibition of N-terminal His6-tagged human Bfl-1 (1 to 151 residues), expressed in Escherichia coli Rosetta2 DE3 by fluorescent labeled FAM-Bid pepti...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBcl-2-like protein 1(Human)
National Institute of Chemistry

Curated by ChEMBL
LigandPNGBDBM50511135(CHEMBL4457901)
Affinity DataKi:  5.20E+3nMAssay Description:Inhibition of N-terminal His6-tagged human Bcl-xL (with internal deletion of 45 to 85 amino acids and C-terminal truncation for 212 to 233 residues) ...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetApoptosis regulator Bcl-2(Human)
National Institute of Chemistry

Curated by ChEMBL
LigandPNGBDBM50511135(CHEMBL4457901)
Affinity DataKi:  5.60E+3nMAssay Description:Inhibition of N-terminal His6-tagged human Bcl-2 isoform 2 (1 to 34 residues and 92 to 202 residues with Bcl-xL sequence (35 to 50 residues) expresse...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed