BDBM362945 3-((6-Chloro-7-fluoro-2-methyl-1-(2-(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-8-yl)acetyl)-1H-indol-3-yl)thio)benzoic acid ::US9850203, Compound 1-12

SMILES CCOC(=O)c1cccc(Sc2c(C)n(CC(=O)N3CCC4(CNC(=O)O4)CC3)c3c(F)c(Cl)ccc23)c1

InChI Key InChIKey=IAFZNSUQSAYWNB-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 = 362945   

TargetAutotaxin(Human)
Pharmakea

US Patent
LigandPNGBDBM362945(US9850203, Compound 1-12 | 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