BDBM50449368 CHEMBL3126334

SMILES CSc1ccc(c(c1)C(=O)O)O

InChI Key InChIKey=DATDARDTUZHWMK-UHFFFAOYSA-N

Data  2 IC50

PDB links: 2 PDB IDs match 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 2 hits for monomerid = 50449368   

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
Research & Development, Abbvie

Curated by ChEMBL
LigandPNGBDBM50449368(CHEMBL3126334)
Affinity DataIC50: 1.60E+5nMAssay Description:Inhibition of human recombinant MCL-1 (174 to 236) expressed in Escherichia coli BL21(DE3) using 6FAM-GELEVEFATQLRRFGDKLN as substrate after 15 mins ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2014
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
Research & Development, Abbvie

Curated by ChEMBL
LigandPNGBDBM50449368(CHEMBL3126334)
Affinity DataIC50: 1.60E+5nMAssay Description:Inhibition of Mcl1 (unknown origin) by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)