BDBM45336 2'-amino-1-methyl-2,5'-dioxo-3'-spiro[indole-3,4'-pyrano[3,2-c][1]benzopyran]carboxylic acid ethyl ester::2'-amino-2,5'-diketo-1-methyl-spiro[indoline-3,4'-pyrano[3,2-c]chromene]-3'-carboxylic acid ethyl ester::MLS000041984::SMR000047024::cid_665770::ethyl 2'-amino-1-methyl-2,5'-dioxospiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate::ethyl 2'-azanyl-1-methyl-2,5'-bis(oxidanylidene)spiro[indole-3,4'-pyrano[3,2-c]chromene]-3'-carboxylate

SMILES CCOC(=O)C1C(=N)Oc2c(c(=O)oc3ccccc23)C11C(=O)N(C)c2ccccc12

InChI Key InChIKey=AGUHMFDEKANFTP-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 = 45336   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45336BDBM45336(cid_665770 | SMR000047024 | ethyl 2'-amino-1-methy...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay