BDBM114042 (4-Oxo-3-o-tolyl-3,4-dihydro-quinazolin-2-ylsulfanyl)-acetic acid [(E)-3-(2-nitro-phenyl)-prop-2-en-(E)-ylidene]-hydrazide::2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]ethanamide::2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]acetamide::2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]acetamide::2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-N-[(E)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]acetamide::MLS000591112::SMR000217910::cid_1553782

SMILES Cc1ccccc1-n1c(SCC(=O)N\N=C\C=C\c2ccccc2[N+]([O-])=O)nc2ccccc2c1=O

InChI Key InChIKey=ABUKZRRTEZITBR-JOARMNLUSA-N

Data  2 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 2 hits for monomerid = 114042   

TargetDisintegrin and metalloproteinase domain-containing protein 17(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM114042((4-Oxo-3-o-tolyl-3,4-dihydro-quinazolin-2-ylsulfan...)
Affinity DataIC50:  6.95E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetDisintegrin and metalloproteinase domain-containing protein 10(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM114042((4-Oxo-3-o-tolyl-3,4-dihydro-quinazolin-2-ylsulfan...)
Affinity DataIC50:  4.51E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay