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Compile Data Set for Download or QSAR

Found 60 hits with Last Name = 'nurminen' and Initial = 'em'   
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
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50105417
PNG
(CHEMBL1089 | Nardil | PHENELZINE | Phenethyl-hydra...)
Show SMILES NNCCc1ccccc1
Show InChI InChI=1S/C8H12N2/c9-10-7-6-8-4-2-1-3-5-8/h1-5,10H,6-7,9H2
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n/an/a 19.9n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416827
PNG
(CHEMBL1241119)
Show SMILES COc1ccc(cc1)C(O)CNN
Show InChI InChI=1S/C9H14N2O2/c1-13-8-4-2-7(3-5-8)9(12)6-11-10/h2-5,9,11-12H,6,10H2,1H3
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n/an/a 28.8n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50341609
PNG
((R)-2-Hydrazino-1-phenylethanol | CHEMBL1766380)
Show SMILES NNC[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C8H12N2O/c9-10-6-8(11)7-4-2-1-3-5-7/h1-5,8,10-11H,6,9H2/t8-/m0/s1
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n/an/a 40n/an/an/an/an/an/a



University of Jyva£skyla£

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 54: 2143-54 (2011)


Article DOI: 10.1021/jm200059p
BindingDB Entry DOI: 10.7270/Q2JH3MH2
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416804
PNG
(CHEMBL1241071)
Show SMILES COc1cccc(c1)C(O)CNN
Show InChI InChI=1S/C9H14N2O2/c1-13-8-4-2-3-7(5-8)9(12)6-11-10/h2-5,9,11-12H,6,10H2,1H3
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n/an/a 52.5n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416818
PNG
(CHEMBL1241428)
Show SMILES CC(CNN)c1ccccc1
Show InChI InChI=1S/C9H14N2/c1-8(7-11-10)9-5-3-2-4-6-9/h2-6,8,11H,7,10H2,1H3
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n/an/a 58.9n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416811
PNG
(CHEMBL1240954)
Show SMILES COc1ccc(CCN(C)N)cc1
Show InChI InChI=1S/C10H16N2O/c1-12(11)8-7-9-3-5-10(13-2)6-4-9/h3-6H,7-8,11H2,1-2H3
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n/an/a 60.3n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50341609
PNG
((R)-2-Hydrazino-1-phenylethanol | CHEMBL1766380)
Show SMILES NNC[C@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C8H12N2O/c9-10-6-8(11)7-4-2-1-3-5-7/h1-5,8,10-11H,6,9H2/t8-/m0/s1
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n/an/a 64.6n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416813
PNG
(CHEMBL1240910)
Show SMILES CN(N)CCc1ccc(Cl)cc1
Show InChI InChI=1S/C9H13ClN2/c1-12(11)7-6-8-2-4-9(10)5-3-8/h2-5H,6-7,11H2,1H3
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n/an/a 70.8n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416807
PNG
(CHEMBL1241004)
Show SMILES CCN(N)CCc1ccc(OC)cc1
Show InChI InChI=1S/C11H18N2O/c1-3-13(12)9-8-10-4-6-11(14-2)7-5-10/h4-7H,3,8-9,12H2,1-2H3
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n/an/a 79.4n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416832
PNG
(CHEMBL1240912)
Show SMILES COc1cccc(CCN(C)N)c1
Show InChI InChI=1S/C10H16N2O/c1-12(11)7-6-9-4-3-5-10(8-9)13-2/h3-5,8H,6-7,11H2,1-2H3
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n/an/a 89.1n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416834
PNG
(CHEMBL1240878)
Show SMILES CN(N)CCc1ccccc1F
Show InChI InChI=1S/C9H13FN2/c1-12(11)7-6-8-4-2-3-5-9(8)10/h2-5H,6-7,11H2,1H3
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n/an/a 91.2n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416815
PNG
(CHEMBL1240879)
Show SMILES CN(N)CCc1ccc(F)cc1
Show InChI InChI=1S/C9H13FN2/c1-12(11)7-6-8-2-4-9(10)5-3-8/h2-5H,6-7,11H2,1H3
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n/an/a 110n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416816
PNG
(CHEMBL1240877)
Show SMILES CN(N)CCc1ccccc1
Show InChI InChI=1S/C9H14N2/c1-11(10)8-7-9-5-3-2-4-6-9/h2-6H,7-8,10H2,1H3
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n/an/a 110n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416833
PNG
(CHEMBL1240909)
Show SMILES CN(N)CCc1cccc(Cl)c1
Show InChI InChI=1S/C9H13ClN2/c1-12(11)6-5-8-3-2-4-9(10)7-8/h2-4,7H,5-6,11H2,1H3
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n/an/a 120n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50341610
PNG
((S)-2-Hydrazino-1-phenylethanol | CHEMBL1766381)
Show SMILES NNC[C@@H](O)c1ccccc1 |r|
Show InChI InChI=1S/C8H12N2O/c9-10-6-8(11)7-4-2-1-3-5-7/h1-5,8,10-11H,6,9H2/t8-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



University of Jyva£skyla£

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 54: 2143-54 (2011)


Article DOI: 10.1021/jm200059p
BindingDB Entry DOI: 10.7270/Q2JH3MH2
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416814
PNG
(CHEMBL1240908)
Show SMILES CN(N)CCc1ccccc1Cl
Show InChI InChI=1S/C9H13ClN2/c1-12(11)7-6-8-4-2-3-5-9(8)10/h2-5H,6-7,11H2,1H3
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n/an/a 170n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416808
PNG
(CHEMBL1241003)
Show SMILES CCN(N)CCc1ccccc1
Show InChI InChI=1S/C10H16N2/c1-2-12(11)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9,11H2,1H3
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n/an/a 182n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416798
PNG
(CHEMBL1241167)
Show SMILES CN(N)CC(O)c1ccc2OCCOc2c1
Show InChI InChI=1S/C11H16N2O3/c1-13(12)7-9(14)8-2-3-10-11(6-8)16-5-4-15-10/h2-3,6,9,14H,4-5,7,12H2,1H3
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n/an/a 200n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416803
PNG
(CHEMBL1241120)
Show SMILES CN(N)CC(O)c1ccccc1
Show InChI InChI=1S/C9H14N2O/c1-11(10)7-9(12)8-5-3-2-4-6-8/h2-6,9,12H,7,10H2,1H3
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n/an/a 209n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416799
PNG
(CHEMBL1241166)
Show SMILES COc1ccc(C(O)CN(C)N)c(OC)c1OC
Show InChI InChI=1S/C12H20N2O4/c1-14(13)7-9(15)8-5-6-10(16-2)12(18-4)11(8)17-3/h5-6,9,15H,7,13H2,1-4H3
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n/an/a 219n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416789
PNG
(CHEMBL1241378)
Show SMILES COC(CN(C)N)c1ccc2ccccc2c1
Show InChI InChI=1S/C14H18N2O/c1-16(15)10-14(17-2)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,14H,10,15H2,1-2H3
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n/an/a 229n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416828
PNG
(CHEMBL1241069)
Show SMILES CN(N)CCCc1ccccc1
Show InChI InChI=1S/C10H16N2/c1-12(11)9-5-8-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9,11H2,1H3
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n/an/a 240n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416796
PNG
(CHEMBL1241289)
Show SMILES CCC[C@@H]([C@H](O)c1ccccc1)N(C)N |r|
Show InChI InChI=1S/C12H20N2O/c1-3-7-11(14(2)13)12(15)10-8-5-4-6-9-10/h4-6,8-9,11-12,15H,3,7,13H2,1-2H3/t11-,12+/m0/s1
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n/an/a 257n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416823
PNG
(CHEMBL1241263)
Show SMILES CC[C@@H]([C@H](O)c1ccccc1)N(C)N |r|
Show InChI InChI=1S/C11H18N2O/c1-3-10(13(2)12)11(14)9-7-5-4-6-8-9/h4-8,10-11,14H,3,12H2,1-2H3/t10-,11+/m0/s1
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416805
PNG
(CHEMBL1241068)
Show SMILES COc1ccc(CCN(N)CC(C)C)cc1
Show InChI InChI=1S/C13H22N2O/c1-11(2)10-15(14)9-8-12-4-6-13(16-3)7-5-12/h4-7,11H,8-10,14H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416788
PNG
(CHEMBL1241379)
Show SMILES CN(N)Cc1ccccc1
Show InChI InChI=1S/C8H12N2/c1-10(9)7-8-5-3-2-4-6-8/h2-6H,7,9H2,1H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416802
PNG
(CHEMBL1241121)
Show SMILES CN(N)CC(O)c1ccccc1Cl
Show InChI InChI=1S/C9H13ClN2O/c1-12(11)6-9(13)7-4-2-3-5-8(7)10/h2-5,9,13H,6,11H2,1H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50341613
PNG
((1R,2S)-2-(1-Methylhydrazino)-1,2-diphenylethanol ...)
Show SMILES CN(N)[C@H]([C@H](O)c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C15H18N2O/c1-17(16)14(12-8-4-2-5-9-12)15(18)13-10-6-3-7-11-13/h2-11,14-15,18H,16H2,1H3/t14-,15+/m0/s1
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University of Jyva£skyla£

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 54: 2143-54 (2011)


Article DOI: 10.1021/jm200059p
BindingDB Entry DOI: 10.7270/Q2JH3MH2
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416801
PNG
(CHEMBL1241123)
Show SMILES COc1cccc(c1)C(O)CN(C)N
Show InChI InChI=1S/C10H16N2O2/c1-12(11)7-10(13)8-4-3-5-9(6-8)14-2/h3-6,10,13H,7,11H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416800
PNG
(CHEMBL1241164)
Show SMILES COc1ccc(cc1)C(O)CN(C)N
Show InChI InChI=1S/C10H16N2O2/c1-12(11)7-10(13)8-3-5-9(14-2)6-4-8/h3-6,10,13H,7,11H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416826
PNG
(CHEMBL1241122)
Show SMILES CN(N)CC(O)c1ccc(Cl)cc1
Show InChI InChI=1S/C9H13ClN2O/c1-12(11)6-9(13)7-2-4-8(10)5-3-7/h2-5,9,13H,6,11H2,1H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416830
PNG
(CHEMBL1241002)
Show SMILES COc1cc(CCN(C)N)cc(OC)c1OC
Show InChI InChI=1S/C12H20N2O3/c1-14(13)6-5-9-7-10(15-2)12(17-4)11(8-9)16-3/h7-8H,5-6,13H2,1-4H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416792
PNG
(CHEMBL1241330)
Show SMILES COC(CN(C)N)c1cccc(C)c1
Show InChI InChI=1S/C11H18N2O/c1-9-5-4-6-10(7-9)11(14-3)8-13(2)12/h4-7,11H,8,12H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416825
PNG
(CHEMBL1241165)
Show SMILES CN(N)CC(O)c1ccc(F)cc1
Show InChI InChI=1S/C9H13FN2O/c1-12(11)6-9(13)7-2-4-8(10)5-3-7/h2-5,9,13H,6,11H2,1H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50341616
PNG
((1S,2R)-2-(1-Methylhydrazino)-1,2-diphenylethanol ...)
Show SMILES CN(N)[C@@H]([C@@H](O)c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C15H18N2O/c1-17(16)14(12-8-4-2-5-9-12)15(18)13-10-6-3-7-11-13/h2-11,14-15,18H,16H2,1H3/t14-,15+/m1/s1
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University of Jyva£skyla£

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 54: 2143-54 (2011)


Article DOI: 10.1021/jm200059p
BindingDB Entry DOI: 10.7270/Q2JH3MH2
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416809
PNG
(CHEMBL1240957)
Show SMILES COc1ccc(CCN(C)N)c(OC)c1OC
Show InChI InChI=1S/C12H20N2O3/c1-14(13)8-7-9-5-6-10(15-2)12(17-4)11(9)16-3/h5-6H,7-8,13H2,1-4H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416786
PNG
(CHEMBL1241430)
Show SMILES COc1ccc(cc1)C(C)(O)CN(C)N
Show InChI InChI=1S/C11H18N2O2/c1-11(14,8-13(2)12)9-4-6-10(15-3)7-5-9/h4-7,14H,8,12H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416812
PNG
(CHEMBL1240911)
Show SMILES COc1ccccc1CCN(C)N
Show InChI InChI=1S/C10H16N2O/c1-12(11)8-7-9-5-3-4-6-10(9)13-2/h3-6H,7-8,11H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416797
PNG
(CHEMBL1241261)
Show SMILES CC(C)CN(N)CC(O)c1ccccc1
Show InChI InChI=1S/C12H20N2O/c1-10(2)8-14(13)9-12(15)11-6-4-3-5-7-11/h3-7,10,12,15H,8-9,13H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416835
PNG
(CHEMBL1241262)
Show SMILES C[C@@H]([C@H](O)c1ccccc1)N(C)N |r|
Show InChI InChI=1S/C10H16N2O/c1-8(12(2)11)10(13)9-6-4-3-5-7-9/h3-8,10,13H,11H2,1-2H3/t8-,10-/m0/s1
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416831
PNG
(CHEMBL1240956)
Show SMILES COc1ccc(CCN(C)N)cc1OC
Show InChI InChI=1S/C11H18N2O2/c1-13(12)7-6-9-4-5-10(14-2)11(8-9)15-3/h4-5,8H,6-7,12H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416810
PNG
(CHEMBL1240955)
Show SMILES COc1ccc(OC)c(CCN(C)N)c1
Show InChI InChI=1S/C11H18N2O2/c1-13(12)7-6-9-8-10(14-2)4-5-11(9)15-3/h4-5,8H,6-7,12H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416817
PNG
(CHEMBL1243019)
Show SMILES COc1ccc(cc1)C(CN(C)N)OCc1ccccc1
Show InChI InChI=1S/C17H22N2O2/c1-19(18)12-17(15-8-10-16(20-2)11-9-15)21-13-14-6-4-3-5-7-14/h3-11,17H,12-13,18H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416819
PNG
(CHEMBL1241377)
Show SMILES COC(CN(C)N)c1cccc2ccccc12
Show InChI InChI=1S/C14H18N2O/c1-16(15)10-14(17-2)13-9-5-7-11-6-3-4-8-12(11)13/h3-9,14H,10,15H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416820
PNG
(CHEMBL1241331)
Show SMILES COC(CN(C)N)c1cccc(OC)c1
Show InChI InChI=1S/C11H18N2O2/c1-13(12)8-11(15-3)9-5-4-6-10(7-9)14-2/h4-7,11H,8,12H2,1-3H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416821
PNG
(CHEMBL1241293)
Show SMILES COC(CN(C)N)c1cccc(Cl)c1
Show InChI InChI=1S/C10H15ClN2O/c1-13(12)7-10(14-2)8-4-3-5-9(11)6-8/h3-6,10H,7,12H2,1-2H3
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FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416791
PNG
(CHEMBL1241332)
Show SMILES COC(CN(C)N)c1ccc(OC)cc1
Show InChI InChI=1S/C11H18N2O2/c1-13(12)8-11(15-3)9-4-6-10(14-2)7-5-9/h4-7,11H,8,12H2,1-3H3
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n/an/a 417n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416824
PNG
(CHEMBL1241260)
Show SMILES CN(N)CC(O)c1ccc2ccccc2c1
Show InChI InChI=1S/C13H16N2O/c1-15(14)9-13(16)12-7-6-10-4-2-3-5-11(10)8-12/h2-8,13,16H,9,14H2,1H3
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n/an/a 427n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416793
PNG
(CHEMBL1241329)
Show SMILES COC(CN(C)N)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H15ClN2O/c1-13(12)7-10(14-2)8-3-5-9(11)6-4-8/h3-6,10H,7,12H2,1-2H3
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PubMed
n/an/a 427n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50416806
PNG
(CHEMBL1241067)
Show SMILES CC(C)CN(N)CCc1ccccc1
Show InChI InChI=1S/C12H20N2/c1-11(2)10-14(13)9-8-12-6-4-3-5-7-12/h3-7,11H,8-10,13H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 437n/an/an/an/an/an/a



FI-40014 University of Jyvaskyla

Curated by ChEMBL


Assay Description
Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method


J Med Chem 53: 6301-15 (2010)


Article DOI: 10.1021/jm100337z
BindingDB Entry DOI: 10.7270/Q2V1261D
More data for this
Ligand-Target Pair
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