BDBM50540272 (+)-Malbrancheamide::CHEMBL508749

SMILES CC1(c2c(c3cc(c(cc3[nH]2)Cl)Cl)C[C@]45[C@H]1C[C@@]6(CCCN6C4)C(=O)N5)C

InChI Key InChIKey=GZGGCZADGIBRHT-UHFFFAOYSA-N

Data  1 IC50

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 1 hit for monomerid = 50540272   

TargetTyrosine-protein phosphatase non-receptor type 1(Human)
University of North Carolina Greensboro

Curated by ChEMBL
LigandPNGBDBM50540272((+)-Malbrancheamide | CHEMBL508749)
Affinity DataIC50: 1.45E+4nMAssay Description:Inhibition of human PTP1B expressed in Escherichia coli BL21 (DE3) cells using PNPP as substate preincubated for 5 mins followed by substrate additon...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed