BDBM321956 (R,E)-tert-Butyl 2-(3-methyl-4-(3-(2-((5-methyl-2H-tetrazol-2-yl)methyl)-4-(trifluoromethyl)phenyl)acryloyl)piperazin-1-yl)acetate::US10183025, Example 65::US9763957, Example 65

SMILES C[C@@H]1CN(CC(=O)OC(C)(C)C)CCN1C(=O)\C=C\c1ccc(cc1Cn1nnc(C)n1)C(F)(F)F

InChI Key InChIKey=YPYHGEGQZFUBNQ-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 = 321956   

TargetAutotaxin(Human)
Novartis

US Patent
LigandPNGBDBM321956((R,E)-tert-Butyl 2-(3-methyl-4-(3-(2-((5-methyl-2H...)
Affinity DataIC50: 5.5nMAssay Description:Reagents LPC (oleoyl (18:1)) was purchased from Avanti Polar Lipids (Alabaster, Ala.) and solubilized in methanol to 20 mM. Amplex Red was obtained f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/16/2019
Entry Details
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TargetAutotaxin(Human)
Novartis

US Patent
LigandPNGBDBM321956((R,E)-tert-Butyl 2-(3-methyl-4-(3-(2-((5-methyl-2H...)
Affinity DataIC50: 5.5nMAssay Description:Method All experimental measurements were performed in black 384 well polystyrene (low volume, round bottom, Corning (3676)) plates. PerkinElmer EnVi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/26/2019
Entry Details
Go to US Patent