BDBM50572936 CHEMBL4858196

SMILES O=C(NCCCP(=O)(O)O)c1ccc2c(C(F)(F)F)c(O[C@H]3CC[C@@H](C(F)(F)F)CC3)ccc2c1

InChI Key InChIKey=KVLHGHHMSGQREN-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 = 50572936   

TargetAutotaxin(Human)
Biogen

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50572936BDBM50572936(CHEMBL4858196)
Affinity DataIC50: 28nMAssay Description:Inhibition of human ATX assessed as reduction in LPA formation using FS-3 as substrate preincubated for 30 mins followed by substrate addition and me...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2022
Entry Details Article
PubMed