BDBM38527 4-[3-(3-Chloro-benzyl)-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl]-piperidine-1-carboxylic acid (4-fluoro-phenyl)-amide::4-[3-(3-chlorobenzyl)-7-keto-2H-triazolo[4,5-d]pyrimidin-5-yl]-N-(4-fluorophenyl)piperidine-1-carboxamide::4-[3-[(3-chlorophenyl)methyl]-7-oxidanylidene-2H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl]-N-(4-fluorophenyl)piperidine-1-carboxamide::4-[3-[(3-chlorophenyl)methyl]-7-oxo-2H-triazolo[4,5-d]pyrimidin-5-yl]-N-(4-fluorophenyl)-1-piperidinecarboxamide::4-[3-[(3-chlorophenyl)methyl]-7-oxo-2H-triazolo[4,5-d]pyrimidin-5-yl]-N-(4-fluorophenyl)piperidine-1-carboxamide::MLS000035382::SMR000007388::cid_649776

SMILES Fc1ccc(NC(=O)N2CCC(CC2)c2nc3n(Cc4cccc(Cl)c4)nnc3c(=O)[nH]2)cc1

InChI Key InChIKey=FWIMGCPNVJGLRK-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 38527   

TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38527(4-[3-(3-Chloro-benzyl)-7-hydroxy-3H-[1,2,3]triazol...)
Affinity DataIC50: 1.71E+5nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38527(4-[3-(3-Chloro-benzyl)-7-hydroxy-3H-[1,2,3]triazol...)
Affinity DataIC50: 1.00E+7nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38527(4-[3-(3-Chloro-benzyl)-7-hydroxy-3H-[1,2,3]triazol...)
Affinity DataIC50: 1.00E+7nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay