BDBM19253 CHEMBL394276::NSC 358285::Tiazofurin Adenine Dinucleotide (TAD)::[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2R,3S,4R,5R)-5-(4-carbamoyl-1,3-thiazol-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]hydrogen phosphate::[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(2R,3S,4R,5R)-5-(4-carbamoyl-1,3-thiazol-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy})phosphinic acid::tiazofurin adenine dinucleotide

SMILES NC(=O)c1csc(n1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O

InChI Key InChIKey=INQLNSVYIFCUML-UHFFFAOYSA-N

Data  4 KI

  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 4 hits for monomerid = 19253   

TargetInosine-5'-monophosphate dehydrogenase 2(Human)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM19253(CHEMBL394276 | NSC 358285 | [(2R,3S,4R,5R)-5-(6-am...)
Affinity DataKi:  100nMAssay Description:Inhibition of human IMPDH 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetInosine-5'-monophosphate dehydrogenase 1(Human)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM19253(CHEMBL394276 | NSC 358285 | [(2R,3S,4R,5R)-5-(6-am...)
Affinity DataKi:  100nMAssay Description:Inhibition of human IMPDH 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetInosine-5'-monophosphate dehydrogenase 2(Human)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM19253(CHEMBL394276 | NSC 358285 | [(2R,3S,4R,5R)-5-(6-am...)
Affinity DataKi:  110nM ΔG°:  -9.49kcal/molepH: 8.0 T: 2°CAssay Description:Inhibition assays were performed in duplicate using two different concentrations of human IMPDH type 2 (33 and 66 nM) and varying concentrations of i...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2007
Entry Details Article
PubMed
TargetInosine-5'-monophosphate dehydrogenase 1(Human)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM19253(CHEMBL394276 | NSC 358285 | [(2R,3S,4R,5R)-5-(6-am...)
Affinity DataKi:  110nM ΔG°:  -9.49kcal/molepH: 8.0 T: 2°CAssay Description:Inhibition assays were performed in duplicate using two different concentrations of human IMPDH type 1 (87 and 155 nM) and varying concentrations of ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/2/2007
Entry Details Article
PubMed