BDBM5117 Methyl 5-isopropyl-3-methyl-2-{[(3-nitrophenyl)-sulfonyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate::methyl 3-methyl-2-[(3-nitrobenzene)sulfonamido]-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate::thiazolidenebenzenesulfonamide deriv. 17j

SMILES COC(=O)c1c(s\c(=N/S(=O)(=O)c2cccc(c2)[N+]([O-])=O)n1C)C(C)C

InChI Key InChIKey=LFGXXVVLMPMFNY-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 5117   

TargetGag-Pol polyprotein [588-1127,Y768C]/[588-1147,Y768C](Human immunodeficiency virus type 1)
Yamanouchi Pharmaceutical

LigandPNGBDBM5117(Methyl 5-isopropyl-3-methyl-2-{[(3-nitrophenyl)-su...)
Affinity DataIC50: 2.50E+4nMAssay Description:The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/19/2005
Entry Details Article
PubMed
TargetGag-Pol polyprotein [588-1027,K690N]/[588-1147,K690N](Human immunodeficiency virus type 1)
Yamanouchi Pharmaceutical

LigandPNGBDBM5117(Methyl 5-isopropyl-3-methyl-2-{[(3-nitrophenyl)-su...)
Affinity DataIC50: 5.00E+4nMAssay Description:The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/19/2005
Entry Details Article
PubMed
TargetGag-Pol polyprotein [588-1027]/[588-1147](Human immunodeficiency virus type 1)
Yamanouchi Pharmaceutical

LigandPNGBDBM5117(Methyl 5-isopropyl-3-methyl-2-{[(3-nitrophenyl)-su...)
Affinity DataIC50: 5.00E+4nMAssay Description:The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/19/2005
Entry Details Article
PubMed