BDBM51622 2-Imino-8-methyl-10-oxo-1-propyl-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid cyclopentylamide::2-azanylidene-N-cyclopentyl-10-methyl-5-oxidanylidene-1-propyl-dipyrido[3,4-c:1',2'-f]pyrimidine-3-carboxamide::MLS000527693::N-cyclopentyl-2-imino-10-methyl-5-oxo-1-propyl-3-dipyrido[3,4-c:1',2'-f]pyrimidinecarboxamide::N-cyclopentyl-2-imino-10-methyl-5-oxo-1-propyldipyrido[3,4-c:1',2'-f]pyrimidine-3-carboxamide::N-cyclopentyl-2-imino-5-keto-10-methyl-1-propyl-dipyrido[3,4-c:1',2'-f]pyrimidine-3-carboxamide::SMR000120267::cid_1077518

SMILES CCCn1c2nc3c(C)cccn3c(=O)c2cc(C(=O)NC2CCCC2)c1=N

InChI Key InChIKey=LBYTYTFRIQXMQJ-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 = 51622   

TargetdTDP-4-dehydrorhamnose 3,5-epimerase(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM51622(N-cyclopentyl-2-imino-10-methyl-5-oxo-1-propyl-3-d...)
Affinity DataIC50: 3.75E+3nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/31/2011
Entry Details
PCBioAssay
TargetTegument protein VP16(HHV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM51622(N-cyclopentyl-2-imino-10-methyl-5-oxo-1-propyl-3-d...)
Affinity DataIC50: 8.54E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2014
Entry Details
PCBioAssay