BDBM40959 5,5-dimethyl-2-[[(5-methyl-4-phenyl-1H-pyrazol-3-yl)amino]methylene]cyclohexane-1,3-quinone::5,5-dimethyl-2-[[(5-methyl-4-phenyl-1H-pyrazol-3-yl)amino]methylidene]cyclohexane-1,3-dione::MLS000084255::SMR000048084::US11529321, Compound 17::cid_666690

SMILES Cc1n[nH]c(NC=C2C(=O)CC(C)(C)CC2=O)c1-c1ccccc1

InChI Key InChIKey=KTPBZQGFLGDNSX-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 = 40959   

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

Curated by PubChem BioAssay
LigandPNGBDBM40959(MLS000084255 | SMR000048084 | cid_666690 | 5,5-dim...)
Affinity DataIC50: 2.57E+3nMAssay 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 Depth
Date in BDB:
5/11/2011
Entry Details
PCBioAssay
TargetProtein-tyrosine kinase 2-beta(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40959(MLS000084255 | SMR000048084 | cid_666690 | 5,5-dim...)
Affinity DataIC50: 2.10E+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 Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetMicrotubule-associated proteins 1A/1B light chain 3B(Human)
Wigen Biomedicine Technology (Shanghai)

US Patent
LigandPNGBDBM40959(MLS000084255 | SMR000048084 | cid_666690 | 5,5-dim...)
Affinity DataIC50: 5.50E+5nMAssay Description:By constructing a prokaryotic expression system, the LC3B protein was expressed and purified, and a preliminary screening and verification platform w...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/16/2023
Entry Details
Go to US Patent