BDBM13995 12-[(1E)-3-[3-hydroxy-2-(methoxycarbonyl)phenoxy]prop-1-en-1-yl]-3-oxa-4-azatricyclo[7.4.0.0^{2,6}]trideca-1(9),2(6),4,10,12-pentaene-5-carboxylic acid::Isoxazole carboxylic acid analog 6

SMILES COC(=O)c1c(O)cccc1OC\C=C\c1ccc2CCc3c(noc3-c2c1)C(O)=O

InChI Key InChIKey=MXDUYHDWIDZURW-ONEGZZNKSA-N

Data  2 KI

  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 2 hits for monomerid = 13995   

TargetTyrosine-protein phosphatase non-receptor type 1 [1-298](Homo sapiens (Human))
Abbott Laboratories

LigandPNGBDBM13995(12-[(1E)-3-[3-hydroxy-2-(methoxycarbonyl)phenoxy]p...)
Affinity DataKi:  1.15E+4nM ΔG°:  -6.67kcal/molepH: 7.5 T: 2°CAssay Description:The phosphatase activity resulted in the formation of the colored product p-nitrophenol, which was continuously monitored at 405 nm every 30 s for 15...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM13995(12-[(1E)-3-[3-hydroxy-2-(methoxycarbonyl)phenoxy]p...)
Affinity DataKi:  1.26E+4nMAssay Description:Inhibition of PTP1BMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed