BDBM50258967 CHEMBL4094527

SMILES Nc1ncnc2n(ncc12)[C@@H]1CCCN(C1)C(=O)C=C

InChI Key InChIKey=QVAUTZCJTDTZTJ-UHFFFAOYSA-N

Data  1 KI  4 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 5 hits for monomerid = 50258967   

TargetEpidermal growth factor receptor(Human)
Tu Dortmund University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50258967BDBM50258967(CHEMBL4094527)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of human recombinant GST-tagged EGFR L858R mutant expressed in baculovirus expression system preincubated for 30 mins followed by ATP and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2019
Entry Details Article
PubMed
TargetTyrosine-protein kinase BTK(Human)
HUN-REN Research Centre for Natural Sciences

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50258967BDBM50258967(CHEMBL4094527)
Affinity DataIC50: 5.00E+3nMAssay Description:Binding affinity to N-terminal 6His-tagged human BTK (387 to 659 residues) extracted from Trichoplusia ni cell incubated for 2 hrs by LC/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetEpidermal growth factor receptor(Human)
Tu Dortmund University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50258967BDBM50258967(CHEMBL4094527)
Affinity DataIC50: 6.90E+3nMAssay Description:Inhibition of wild type N-terminal GST-fused human EGFR cytoplasmic domain expressed in baculovirus expression system preincubated for 30 mins follow...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2019
Entry Details Article
PubMed
TargetEpidermal growth factor receptor(Human)
Tu Dortmund University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50258967BDBM50258967(CHEMBL4094527)
Affinity DataIC50: 6.90E+3nMAssay Description:Inhibition of wild type N-terminal GST-fused human EGFR cytoplasmic domain expressed in baculovirus expression system preincubated for 30 mins follow...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/29/2019
Entry Details Article
PubMed
TargetTyrosine-protein kinase BTK(Human)
HUN-REN Research Centre for Natural Sciences

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50258967BDBM50258967(CHEMBL4094527)
Affinity DataKi:  3.16E+5nMAssay Description:Binding affinity to N-terminal 6His-tagged human BTK (387 to 659 residues) extracted from Trichoplusia ni cell assessed as inhibition constant incuba...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed