BDBM87473 4-Amino-isothiazole-3,5-dicarboxylic acid 3-amide 5-((2-ethoxy-phenyl)-{quinolin-6-yl-[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-amide)::4-amino-5-N-(2-ethoxyphenyl)-5-N-[2-oxo-2-(oxolan-2-ylmethylamino)-1-quinolin-6-ylethyl]-1,2-thiazole-3,5-dicarboxamide::4-amino-N'-[2-keto-1-(6-quinolyl)-2-(tetrahydrofurfurylamino)ethyl]-N'-o-phenetyl-isothiazole-3,5-dicarboxamide::4-amino-N5-(2-ethoxyphenyl)-N5-[2-oxo-2-(2-oxolanylmethylamino)-1-(6-quinolinyl)ethyl]isothiazole-3,5-dicarboxamide::4-azanyl-N5-(2-ethoxyphenyl)-N5-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)-1-quinolin-6-yl-ethyl]-1,2-thiazole-3,5-dicarboxamide::MLS001220721::SMR000600156::cid_3189214

SMILES CCOc1ccccc1N(C(C(=O)NCC1CCCO1)c1ccc2ncccc2c1)C(=O)c1snc(C(N)=O)c1N

InChI Key InChIKey=KFNBCXQKWCDMIF-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 87473   

TargetTyrosine-protein kinase ABL1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87473(4-Amino-isothiazole-3,5-dicarboxylic acid 3-amide ...)
Affinity DataIC50:  2.51E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay