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PubMed code 1573631

Compile data set for download or QSAR
Found 16 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005726
PNG
(CHEMBL27061 | O-(3-Amino-2-fluoro-propyl)-hydroxyl...)
Show SMILES NCC(F)CON
Show InChI InChI=1S/C3H9FN2O/c4-3(1-5)2-7-6/h3H,1-2,5-6H2
PDB
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n/an/a 14n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005712
PNG
((S)1-Amino-3-aminooxy-propan-2-ol | CHEMBL26435)
Show SMILES NC[C@H](O)CON
Show InChI InChI=1S/C3H10N2O2/c4-1-3(6)2-7-5/h3,6H,1-2,4-5H2/t3-/m0/s1
PDB
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PubMed
n/an/a 33n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005719
PNG
((APA)O-(3-Amino-propyl)-hydroxylamine | 3-AMINOOXY...)
Show InChI InChI=1S/C3H10N2O/c4-2-1-3-6-5/h1-5H2
PDB
MMDB

KEGG

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PubMed
n/an/a 35n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005727
PNG
(1-Amino-3-aminooxy-propan-2-ol | CHEMBL26857)
Show SMILES NCC(O)CON
Show InChI InChI=1S/C3H10N2O2/c4-1-3(6)2-7-5/h3,6H,1-2,4-5H2
PDB
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n/an/a 39n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005725
PNG
((R)1-Amino-3-aminooxy-propan-2-ol | CHEMBL284573)
Show SMILES NC[C@@H](O)CON
Show InChI InChI=1S/C3H10N2O2/c4-1-3(6)2-7-5/h3,6H,1-2,4-5H2/t3-/m1/s1
PDB
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KEGG

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n/an/a 49n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005714
PNG
(CHEMBL15650 | O-(3-Amino-2-chloro-propyl)-hydroxyl...)
Show SMILES NCC(Cl)CON
Show InChI InChI=1S/C3H9ClN2O/c4-3(1-5)2-7-6/h3H,1-2,5-6H2
PDB
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n/an/a 93n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005713
PNG
(CHEMBL282411 | Methanesulfonic acid 1-aminomethyl-...)
Show SMILES CS(=O)(=O)OC(CN)CON
Show InChI InChI=1S/C4H12N2O4S/c1-11(7,8)10-4(2-5)3-9-6/h4H,2-3,5-6H2,1H3
PDB
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n/an/a 1.10E+3n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005724
PNG
(1-Aminooxy-3-methylamino-propan-2-ol | CHEMBL26797)
Show SMILES CNCC(O)CON
Show InChI InChI=1S/C4H12N2O2/c1-6-2-4(7)3-8-5/h4,6-7H,2-3,5H2,1H3
PDB
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n/an/a 1.90E+3n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005723
PNG
(2-Fluoro-3-hydrazino-propylamine | CHEMBL26945)
Show SMILES NCC(F)CNN
Show InChI InChI=1S/C3H10FN3/c4-3(1-5)2-7-6/h3,7H,1-2,5-6H2
PDB
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n/an/a 3.30E+3n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005718
PNG
(CHEMBL25868 | Phosphoric acid mono-{4-[(3-amino-2-...)
Show SMILES Cc1ncc(COP(O)(O)=O)c(\C=N\OCC(F)CN)c1O
Show InChI InChI=1S/C11H17FN3O6P/c1-7-11(16)10(4-15-20-6-9(12)2-13)8(3-14-7)5-21-22(17,18)19/h3-4,9,16H,2,5-6,13H2,1H3,(H2,17,18,19)/b15-4+
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n/an/a 5.20E+3n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005721
PNG
(1-Aminooxy-3-prop-2-ynylamino-propan-2-ol | CHEMBL...)
Show SMILES NOCC(O)CNCC#C
Show InChI InChI=1S/C6H12N2O2/c1-2-3-8-4-6(9)5-10-7/h1,6,8-9H,3-5,7H2
PDB
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n/an/a 8.40E+3n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005722
PNG
(1-Allylamino-3-aminooxy-propan-2-ol | CHEMBL26418)
Show SMILES NOCC(O)CNCC=C
Show InChI InChI=1S/C6H14N2O2/c1-2-3-8-4-6(9)5-10-7/h2,6,8-9H,1,3-5,7H2
PDB
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n/an/a 2.10E+4n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005715
PNG
(CHEMBL27045 | Phosphoric acid mono-{4-[(3-amino-2-...)
Show SMILES Cc1ncc(COP(O)(O)=O)c(\C=N\OCC(O)CN)c1O
Show InChI InChI=1S/C11H18N3O7P/c1-7-11(16)10(4-14-20-6-9(15)2-12)8(3-13-7)5-21-22(17,18)19/h3-4,9,15-16H,2,5-6,12H2,1H3,(H2,17,18,19)/b14-4+
PDB
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n/an/a 2.40E+4n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005716
PNG
(1-Aminooxy-3-dimethylamino-propan-2-ol | CHEMBL170...)
Show SMILES CN(C)CC(O)CON
Show InChI InChI=1S/C5H14N2O2/c1-7(2)3-5(8)4-9-6/h5,8H,3-4,6H2,1-2H3
PDB
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n/an/a>5.00E+4n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005717
PNG
(1-Aminooxy-3-isopropylamino-propan-2-ol | CHEMBL26...)
Show SMILES CC(C)NCC(O)CON
Show InChI InChI=1S/C6H16N2O2/c1-5(2)8-3-6(9)4-10-7/h5-6,8-9H,3-4,7H2,1-2H3
PDB
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n/an/a 6.60E+4n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
Ornithine decarboxylase


(Rattus norvegicus)
BDBM50005720
PNG
(1,3-Bis-aminooxy-propan-2-ol | CHEMBL287667)
Show SMILES NOCC(O)CON
Show InChI InChI=1S/C3H10N2O3/c4-7-1-3(6)2-8-5/h3,6H,1-2,4-5H2
PDB
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n/an/a 6.70E+5n/an/an/an/an/an/a



Ciba-Geigy AG.

Curated by ChEMBL


Assay Description
Inhibitory activity against Rat liver ornithine decarboxylase(ODC)


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%