BDBM40943 (2-Isopropyl-quinazolin-4-ylsulfanyl)-acetic acid methyl ester::2-[(2-isopropylquinazolin-4-yl)thio]acetic acid methyl ester::2-[(2-propan-2-yl-4-quinazolinyl)thio]acetic acid methyl ester::MLS000074241::SMR000006837::cid_652110::methyl 2-(2-propan-2-ylquinazolin-4-yl)sulfanylacetate::methyl 2-(2-propan-2-ylquinazolin-4-yl)sulfanylethanoate

SMILES COC(=O)CSc1nc(nc2ccccc12)C(C)C

InChI Key InChIKey=RXCTXYJPRWUXHX-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 40943   

TargetFocal adhesion kinase 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40943((2-Isopropyl-quinazolin-4-ylsulfanyl)-acetic acid ...)
Affinity DataIC50:  1.25E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetMajor prion protein(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40943((2-Isopropyl-quinazolin-4-ylsulfanyl)-acetic acid ...)
Affinity DataIC50:  910nMAssay 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
TargetProtein-tyrosine kinase 2-beta(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40943((2-Isopropyl-quinazolin-4-ylsulfanyl)-acetic acid ...)
Affinity DataIC50: >6.95E+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