BDBM64795 4-O-[5-bromo-3-(4-methoxyphenyl)-7-methyl-2-(2-methylpropyl)-6,8-dioxoisoquinolin-7-yl] 1-O-methyl butanedioate::CMLD004098::MLS001045834::O4-[5-bromanyl-3-(4-methoxyphenyl)-7-methyl-2-(2-methylpropyl)-6,8-bis(oxidanylidene)isoquinolin-7-yl] O1-methyl butanedioate::SMR000452731::butanedioic acid O4-[5-bromo-3-(4-methoxyphenyl)-7-methyl-2-(2-methylpropyl)-6,8-dioxo-7-isoquinolinyl] ester O1-methyl ester::cid_16745758::succinic acid O4-[5-bromo-2-isobutyl-6,8-diketo-3-(4-methoxyphenyl)-7-methyl-7-isoquinolyl] ester O1-methyl ester

SMILES COC(=O)CCC(=O)OC1(C)C(=O)C(Br)=C2C=C(N(CC(C)C)C=C2C1=O)c1ccc(OC)cc1

InChI Key InChIKey=MFAIIRGKMQBKFB-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 64795   

TargetSerine/threonine-protein phosphatase PP1-alpha catalytic subunit(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM64795(cid_16745758 | SMR000452731 | butanedioic acid O4-...)
Affinity DataIC50: 2.83E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay
TargetSerine/threonine-protein phosphatase(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM64795(cid_16745758 | SMR000452731 | butanedioic acid O4-...)
Affinity DataIC50: 3.75E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay