BDBM304912 3-(4-Cyano-2-methylphenyl)- 3-(3-((7-methoxy-4-methyl- 1,1-dioxido-4,5-dihydrobenzo [f][1,2]thiazepin-2(3H)-yl) methyl)-4-methylphenyl) propanoic acid::US10144731, Example 216

SMILES COc1ccc2c(CC(C)CN(Cc3cc(ccc3C)C(CC(O)=O)c3ccc(cc3C)C#N)S2(=O)=O)c1

InChI Key InChIKey=GIPUEKGFFDJJJJ-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 2 hits for monomerid = 304912   

TargetKelch-like ECH-associated protein 1 [321-609](Human)
Glaxosmithkline

US Patent
LigandChemical structure of BindingDB Monomer ID 304912BDBM304912(3-(4-Cyano-2-methylphenyl)- 3-(3-((7-methoxy-4-met...)
Affinity DataIC50: 55nMAssay Description:100 nL of 100× compound dose response curves (serial 3-fold dilutions) in DMSO are stamped using an Echo liquid handling system (Labcyte) into 384-we...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2019
Entry Details
US Patent

TargetNuclear factor erythroid 2-related factor 2(Human)
Glaxosmithkline

US Patent
LigandChemical structure of BindingDB Monomer ID 304912BDBM304912(3-(4-Cyano-2-methylphenyl)- 3-(3-((7-methoxy-4-met...)
Affinity DataEC50:  55nMAssay Description:NAD(P)H:quinone oxidoreductase 1 (NQO1), also called DT diaphorase, is a homodimeric FAD-containing enzyme that catalyzes obligatory NAD(P)H-dependen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/30/2019
Entry Details
US Patent