BDBM50520327 CHEMBL4456044

SMILES COc1nc(ccc1Nc1ccc(CN(C)C)cc1)-c1cccc2OCCOc12

InChI Key InChIKey=MJHHFDJNRRCUOB-UHFFFAOYSA-N

Data  3 Kd

  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 3 hits for monomerid = 50520327   

TargetGTPase HRas(Human)
Frontier Medicines

Curated by ChEMBL
LigandPNGBDBM50520327(CHEMBL4456044)
Affinity DataKd:  51nMAssay Description:Inhibition GST-tagged recombinant HRAS G12V mutant (1 to 166 amino acids) (unknown origin) expressed in Escherichia coli C41(DE3) by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed
TargetGTPase KRas(Human)
Jinan University

Curated by ChEMBL
LigandPNGBDBM50520327(CHEMBL4456044)
Affinity DataKd:  51nMAssay Description:Binding affinity to GST-tagged GppNHp bound KRas G12V mutant (unknown origin) expressed in Escherichia coli C41(DE3) by 1H-CPMG NMR spectroscopyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2022
Entry Details Article
PubMed
TargetGTPase KRas(Human)
Jinan University

Curated by ChEMBL
LigandPNGBDBM50520327(CHEMBL4456044)
Affinity DataKd:  51nMAssay Description:Binding affinity to GppNHp-tagged KRAS G12V mutant (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed