BDBM59995 2-chloranyl-5-[2,5-dimethyl-3-[(E)-[2,4,6-tris(oxidanylidene)-1-(phenylmethyl)-1,3-diazinan-5-ylidene]methyl]pyrrol-1-yl]benzoic acid::2-chloro-5-[2,5-dimethyl-3-[(E)-[2,4,6-trioxo-1-(phenylmethyl)-1,3-diazinan-5-ylidene]methyl]-1-pyrrolyl]benzoic acid::5-[3-[(E)-(1-benzyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]-2-chloro-benzoic acid::5-[3-[(E)-(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]-2-chlorobenzoic acid::5-{3-[(1-benzyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-2-chlorobenzoic acid::MLS000704570::SMR000230935::cid_1728957

SMILES Cc1cc(\C=C2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)c(c1)C(O)=O

InChI Key InChIKey=SFRAROVBRVKZJH-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 59995   

TargetM17 leucyl aminopeptidase(Plasmodium falciparum (isolate 3D7))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM59995(cid_1728957 | SMR000230935 | 5-{3-[(1-benzyl-2,4,6...)
Affinity DataIC50: 7.27E+4nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay
LigandPNGBDBM59995(cid_1728957 | SMR000230935 | 5-{3-[(1-benzyl-2,4,6...)
Affinity DataIC50: 1.03E+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:
1/4/2012
Entry Details
PCBioAssay
TargetDNA (cytosine-5)-methyltransferase 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM59995(cid_1728957 | SMR000230935 | 5-{3-[(1-benzyl-2,4,6...)
Affinity DataIC50: 3.35E+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:
6/19/2012
Entry Details
PCBioAssay