BDBM363041 3-((6-Chloro-7-fluoro-1-(2-((3S,4S)-3-hydroxy-4-(4-methylpiperazin-1-yl)pyrrolidin-1-yl)-2-oxoethyl)-2-methyl-1H-indol-3-yl)thio)-2-fluorobenzoic acid ::US9850203, Compound 2-70

SMILES CN1CCN(CC1)[C@H]1CN(C[C@@H]1O)C(=O)Cn1c(C)c(Sc2cccc(C(O)=O)c2F)c2ccc(Cl)c(F)c12

InChI Key InChIKey=BCFYETQPVNNEEC-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 363041   

TargetAutotaxin(Human)
Pharmakea

US Patent
LigandPNGBDBM363041(US9850203, Compound 2-70 | 3-((6-Chloro-7-fluoro-1...)
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
US Patent