BDBM50535217 CHEMBL4458386

SMILES Clc1cccc(CNc2ncc3CN(CCc3n2)C(=O)CCc2ccc3[nH]c(=O)oc3c2)c1

InChI Key InChIKey=XJUBAULHEIZVMB-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50535217   

TargetAutotaxin(Human)
Lilly Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50535217(CHEMBL4458386)
Affinity DataIC50: 52nMAssay Description:Inhibition of recombinant full length human C-terminal His-tagged autotaxin expressed in human 293E cells assessed as choline release using lysophosp...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetAutotaxin(Human)
Lilly Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50535217(CHEMBL4458386)
Affinity DataIC50: 796nMAssay Description:Inhibition of autotaxin in healthy human plasma assessed as reduction in LPA level after 3 hrs by mass spectrometric analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed