BDBM50574370 CHEMBL4846168::US20230271956, Compound 1

SMILES CCc1c(nn2cc(Cl)c(cc12)C(=O)Nc1ncn(CC)n1)C(O)(c1ccccc1)c1ccccc1

InChI Key InChIKey=WLUNFHGEBAZYCQ-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50574370   

TargetAcetyl-coenzyme A synthetase, cytoplasmic(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50574370(CHEMBL4846168 | US20230271956, Compound 1)
Affinity DataIC50:  0.0100nMAssay Description:Inhibition of human recombinant ACSS2 incubated for 180 mins by AMP Glo assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAcetyl-coenzyme A synthetase, cytoplasmic(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50574370(CHEMBL4846168 | US20230271956, Compound 1)
Affinity DataIC50: <1nMAssay Description:The biochemical activity assay for ACSS2 is based on the detection of released AMP by AMP-Glo Assay kit (Promega, Madison). The assay is run in three...More data for this Ligand-Target Pair
In DepthDetails US Patent


TargetAcetyl-coenzyme A synthetase, cytoplasmic(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50574370(CHEMBL4846168 | US20230271956, Compound 1)
Affinity DataIC50:  0.0100nMAssay Description:Inhibition of ACSS2 in human HCT-15 cells assessed as inhibition of 14C acetate incorporation into histones by microbeta scintillation counting analy...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAcetyl-coenzyme A synthetase, cytoplasmic(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50574370(CHEMBL4846168 | US20230271956, Compound 1)
Affinity DataIC50:  0.0100nMAssay Description:Inhibition of ACSS2 in human HCT-15 cells assessed as inhibition of 14C acetate incorporation into fatty acids by microbeta scintillation counting an...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed