BDBM50657777 CHEMBL6160966

SMILES C=CC(=O)Nc1ccc(OC)c(Nc2cc(-c3[nH]c(SC)nc3-c3cccc(NC(=O)c4cccc(O)c4CN4Cc5ccccc5C4=O)c3)ccn2)c1

InChI Key InChIKey=KJPTTYYGYCVLFE-UHFFFAOYSA-N

Data  3 KI  1 IC50

  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 4 hits for monomerid = 50657777   

TargetEpidermal growth factor receptor(Human)
Eberhard Karls Universitat Tubingen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657777BDBM50657777(CHEMBL6160966)
Affinity DataIC50: 1.20nMAssay Description:Irreversible inhibition of EGFR L858R/T790M/C797S mutant (696 to 1022 residues) (unknown origin) extracted from baculovirus infected Sf9 insect cells...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetEpidermal growth factor receptor(Human)
Eberhard Karls Universitat Tubingen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657777BDBM50657777(CHEMBL6160966)
Affinity DataKi:  276nMAssay Description:Time-dependent irreversible inhibition of GST-tagged EGFR L858R mutant cytoplasmic domain (669 to 1210 residues) (unknown origin) assessed as apparen...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetEpidermal growth factor receptor(Human)
Eberhard Karls Universitat Tubingen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657777BDBM50657777(CHEMBL6160966)
Affinity DataKi:  543nMAssay Description:Time-dependent irreversible inhibition of GST-tagged EGFR L858R/T790M mutant cytoplasmic domain (669 to 1210 residues) (unknown origin) assessed as a...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetEpidermal growth factor receptor(Human)
Eberhard Karls Universitat Tubingen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657777BDBM50657777(CHEMBL6160966)
Affinity DataKi:  1.32E+3nMAssay Description:Time-dependent irreversible inhibition of N-terminal GST-tagged wildtype human EGFR cytoplasmic domain (669 to 1210 residues) extracted from Sf21 ins...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed