BDBM362979 3-((6-Chloro-7-fluoro-2-methyl-1-(2-oxo-2-(10-oxo-3,9-diazaspiro[5.6]dodecan-3-yl)ethyl)-1H-indol-3-yl)thio)benzoic acid ::US9850203, Compound 1-53

SMILES Cc1c(Sc2cccc(c2)C(O)=O)c2ccc(Cl)c(F)c2n1CC(=O)N1CCC2(CC1)CCNC(=O)CC2

InChI Key InChIKey=CKPYMRNJAPCETC-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 = 362979   

TargetAutotaxin(Human)
Pharmakea

US Patent
LigandPNGBDBM362979(US9850203, Compound 1-53 | 3-((6-Chloro-7-fluoro-2...)
Affinity DataIC50: 500nMAssay Description:ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/14/2019
Entry Details
Go to US Patent