BDBM50562645 CHEMBL4781219

SMILES C=CC(=O)N1CCN(c2nc(=O)n(-c3c(C(C)C)cccc3C(C)C)c3c(F)c(-c4c(O)cccc4F)ncc23)[C@@H](C)C1

InChI Key InChIKey=XIZZNOJBCRUFPP-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50562645   

TargetGTPase KRas(Human)
Shanghai Institute of Materia Medica (Simm)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50562645BDBM50562645(CHEMBL4781219)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human N-terminal His-tagged KRAS (2 to 185 residues) expressed in baculovirus infected Sf9 insect cells using GTP as substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/29/2022
Entry Details Article
PubMed