BDBM50009353 1,5,10-triazadecane::4-azaoctamethylenediamine::4-azaoctane-1,8-diamine::CHEMBL19612::N-(3-aminopropyl)butane-1,4-diamine::spermidine

SMILES NCCCCNCCCN

InChI Key InChIKey=ATHGHQPFGPMSJY-UHFFFAOYSA-N

Data  16 KI  4 IC50

PDB links: 214 PDB IDs match this monomer.

  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 20 hits for monomerid = 50009353   

TargetCoagulation factor XIII A chain [Q652E](Human)
Xavier University of Louisiana

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human coagulation factor XIIIa assessed as inhibition of factor 13a mediated crosslinking of fibronectin-collagen incubated for 2 hrs b...More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetPyruvate kinase PKM(Human)
Central University of Punjab

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataIC50: 1.41E+3nMAssay Description:Inhibition of PKM2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails
PubMed
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of bovine calmodulin-activated cAMP dependent phosphodiesteraseMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetDNA topoisomerase 2-alpha(Human)
Alma Mater Studiorum-University of Bologna

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataIC50: 1.00E+6nMAssay Description:Inhibition of recombinant human topoisomerase-2alpha expressed in Saccharomyces cerevisiae JEL1 harboring topoisomerase1 deletion mutant assessed as ...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 4(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  112nMAssay Description:Inhibition of human carbonic anhydrase 4 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 14(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.00E+3nMAssay Description:Inhibition of human carbonic anhydrase 14 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 2(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.11E+3nMAssay Description:Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 5A, mitochondrial(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.22E+3nMAssay Description:Inhibition of human carbonic anhydrase 5A by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 7(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.23E+3nMAssay Description:Inhibition of human carbonic anhydrase 7 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 9(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.37E+3nMAssay Description:Inhibition of human carbonic anhydrase 9 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 1(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.40E+3nMAssay Description:Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 6(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.41E+3nMAssay Description:Inhibition of human carbonic anhydrase 6 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 5B, mitochondrial(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.44E+3nMAssay Description:Inhibition of human carbonic anhydrase 5B by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetGlutamate receptor ionotropic, NMDA 1(Rat)
F. Hoffmann-La Roche

Curated by PDSP Ki Database
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 15(Mouse)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.00E+4nMAssay Description:Inhibition of mouse carbonic anhydrase 15 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 3(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.15E+4nMAssay Description:Inhibition of human carbonic anhydrase 3 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 13(Mouse)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  1.16E+4nMAssay Description:Inhibition of mouse carbonic anhydrase 13 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetCarbonic anhydrase 12(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  4.41E+4nMAssay Description:Inhibition of human carbonic anhydrase 12 by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetOrnithine decarboxylase(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  2.70E+6nMAssay Description:Competitive inhibition of Sprague-Dawley rat prostate ornithine decarboxylase using DL-[1-14C]ornithine as substrate by liquid scintillation counting...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetOrnithine decarboxylase(Bovine)
TBA

Curated by ChEMBL
LigandPNGBDBM50009353(spermidine | 4-azaoctane-1,8-diamine | 4-azaoctame...)
Affinity DataKi:  3.00E+6nMAssay Description:Competitive inhibition of bull prostate ornithine decarboxylase using DL-[1-14C]ornithine as substrate after 1 hr by dixon plot analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed