BDBM580599 US11492341, Compound I-94

SMILES Oc1c(Cl)cccc1S(=O)(=O)n1c(cc2cc(Cl)ccc12)-c1cncnc1

InChI Key InChIKey=BUNFYCCNXWCSKO-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 580599   

TargetATP-citrate synthase(Human)
Nimbus Artemis

US Patent
LigandPNGBDBM580599(US11492341, Compound I-94)
Affinity DataIC50: 1.03E+4nMAssay Description:Compounds of the present invention were evaluated in an ADP-GLO assay as follows:a) Dilute cpd 1:3 in succession in DMSO by hand for each cpds for 12...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/20/2023
Entry Details
US Patent