BDBM50400178 2,3‐dihydroxy‐6‐[(4‐ methylphenyl)sulfanyl]anthracene‐9,10‐dione (Ligand 5)::CHEMBL2180318

SMILES Cc1ccc(Sc2ccc3C(=O)c4cc(O)c(O)cc4C(=O)c3c2)cc1

InChI Key InChIKey=HCYYGYJUUDXTAS-UHFFFAOYSA-N

Data  2 KI  1 Kd  1 ITC

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50400178   

TargetInduced myeloid leukemia cell differentiation protein Mcl-1 [172-327](Human)
Dalian University of Technology

LigandBDBM50400178(CHEMBL2180318 | 2,3‐dihydroxy‐6‐...)Copy SMILESCopy InChI

Affinity DataKd:  950nMpH: 8.0 T: 2°CAssay Description:ITC experiments were carried out using iTC200 (Microcal LLC, Northampton, MA, USA) with each of the compounds 1-6 and Mcl-1 protein. The heat of rea...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
3/20/2014
Entry Details Article
Copy Entry DOIPubMed
Copy Rxn URL

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
Dalian University of Technology

Curated by ChEMBL

LigandBDBM50400178(CHEMBL2180318 | 2,3‐dihydroxy‐6‐...)Copy SMILESCopy InChI

Affinity DataKi:  38nMAssay Description:Binding affinity to Mcl-1 after 30 mins by florescence polarization assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
5/17/2013
Entry Details Article
Copy Entry DOIPubMed
Copy Rxn URL

TargetApoptosis regulator Bcl-2(Human)
Dalian University of Technology

Curated by ChEMBL

LigandBDBM50400178(CHEMBL2180318 | 2,3‐dihydroxy‐6‐...)Copy SMILESCopy InChI

Affinity DataKi:  44nMAssay Description:Binding affinity to Bcl-2 after 30 mins by florescence polarization assayMore data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
5/17/2013
Entry Details Article
Copy Entry DOIPubMed
Copy Rxn URL