BDBM61587 (4S)-1-benzyl-4-(3-fluorophenyl)-6-methyl-2-(p-anisylamino)-4H-pyrimidine-5-carboxylic acid methyl ester::(4S)-4-(3-fluorophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylic acid methyl ester::MLS000829932::SMR000672090::cid_24789248::methyl (4S)-1-benzyl-4-(3-fluorophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-4H-pyrimidine-5-carboxylate::methyl (4S)-4-(3-fluorophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate

SMILES COC(=O)C1=C(C)N(Cc2ccccc2)C(NCc2ccc(OC)cc2)=N[C@H]1c1cccc(F)c1

InChI Key InChIKey=UIMSXZLBMOIYCC-UHFFFAOYSA-N

Data  2 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 3 hits for monomerid = 61587   

TargetG-protein coupled receptor 55(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61587(MLS000829932 | cid_24789248 | (4S)-4-(3-fluorophen...)
Affinity DataIC50: 1.46E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM61587(MLS000829932 | cid_24789248 | (4S)-4-(3-fluorophen...)
Affinity DataIC50: 2.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetGlycogen synthase kinase-3 beta(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM61587(MLS000829932 | cid_24789248 | (4S)-4-(3-fluorophen...)
Affinity DataEC50: >3.00E+5nMAssay Description:Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/29/2011
Entry Details
PCBioAssay