BDBM72114 1-bromanyl-4-(4-chlorophenyl)-8-fluoranyl-isoquinolin-3-amine::1-bromo-4-(4-chlorophenyl)-8-fluoro-3-isoquinolinamine::1-bromo-4-(4-chlorophenyl)-8-fluoro-3-isoquinolinylamine::1-bromo-4-(4-chlorophenyl)-8-fluoroisoquinolin-3-amine::MLS000325769::SMR000169784::[1-bromo-4-(4-chlorophenyl)-8-fluoro-3-isoquinolyl]amine::cid_1478886

SMILES CC(C)c1ccc(N2C[C@H](CS(C)(=O)=O)[C@H]2C)c2cnc(Nc3ccnc(-c4cn[nH]c4)n3)cc12

InChI Key InChIKey=BOFIIENWQLWQQA-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 72114   

TargetEpidermal growth factor receptor [L858R,T790M,C797S](Human)
Shanghai Hansoh Biomedical

US Patent
LigandChemical structure of BindingDB Monomer ID 72114BDBM72114(N-(2-(1H-pyrazol-4-yl)pyrimidin-4-yl)-5-isopropyl-...)
Affinity DataIC50: 0.710nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details
US Patent

TargetEpidermal growth factor receptor [1-18,20-1210,T790M,C797S](Human)
Shanghai Hansoh Biomedical

US Patent
LigandChemical structure of BindingDB Monomer ID 72114BDBM72114(N-(2-(1H-pyrazol-4-yl)pyrimidin-4-yl)-5-isopropyl-...)
Affinity DataIC50: 3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details
US Patent