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Compile Data Set for Download or QSAR

Found 1053 hits with Last Name = 'smithen' and Initial = 'd'   
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
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526723
PNG
(CHEMBL4515085 | US10807974, Example 121 | US109950...)
Show SMILES Cc1ccc(cc1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)S(C)(=O)=O
Show InChI InChI=1S/C18H18N2O4S3/c1-12-3-5-13(6-4-12)14-7-15(26(2,21)22)9-16(8-14)27(23,24)18-11-20-17(10-19)25-18/h3-9,11H,10,19H2,1-2H3
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 28n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526723
PNG
(CHEMBL4515085 | US10807974, Example 121 | US109950...)
Show SMILES Cc1ccc(cc1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)S(C)(=O)=O
Show InChI InChI=1S/C18H18N2O4S3/c1-12-3-5-13(6-4-12)14-7-15(26(2,21)22)9-16(8-14)27(23,24)18-11-20-17(10-19)25-18/h3-9,11H,10,19H2,1-2H3
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 28n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526723
PNG
(CHEMBL4515085 | US10807974, Example 121 | US109950...)
Show SMILES Cc1ccc(cc1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)S(C)(=O)=O
Show InChI InChI=1S/C18H18N2O4S3/c1-12-3-5-13(6-4-12)14-7-15(26(2,21)22)9-16(8-14)27(23,24)18-11-20-17(10-19)25-18/h3-9,11H,10,19H2,1-2H3
PDB

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TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469087
PNG
(US10807974, Example 106 | US10995088, Example 106 ...)
Show SMILES CCc1cc(CC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H18N2O2S2/c1-3-10-5-11(4-2)7-12(6-10)20(17,18)14-9-16-13(8-15)19-14/h5-7,9H,3-4,8,15H2,1-2H3
PDB

UniProtKB/SwissProt

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n/an/a 45n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469087
PNG
(US10807974, Example 106 | US10995088, Example 106 ...)
Show SMILES CCc1cc(CC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H18N2O2S2/c1-3-10-5-11(4-2)7-12(6-10)20(17,18)14-9-16-13(8-15)19-14/h5-7,9H,3-4,8,15H2,1-2H3
PDB

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n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469087
PNG
(US10807974, Example 106 | US10995088, Example 106 ...)
Show SMILES CCc1cc(CC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H18N2O2S2/c1-3-10-5-11(4-2)7-12(6-10)20(17,18)14-9-16-13(8-15)19-14/h5-7,9H,3-4,8,15H2,1-2H3
PDB

UniProtKB/SwissProt

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n/an/a 45n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469088
PNG
(US10807974, Example 107 | US10995088, Example 107 ...)
Show SMILES CCc1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-4-3-5-10(6-9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
PDB

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n/an/a 56n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469088
PNG
(US10807974, Example 107 | US10995088, Example 107 ...)
Show SMILES CCc1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-4-3-5-10(6-9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
PDB

UniProtKB/SwissProt

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n/an/a 56n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469029
PNG
(US10807974, Example 14 | US10807974, Example 42 | ...)
Show SMILES NCc1ccc(s1)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C15H18N2O4S3/c16-11-12-6-7-15(22-12)23(18,19)13-4-3-5-14(10-13)24(20,21)17-8-1-2-9-17/h3-7,10H,1-2,8-9,11,16H2
PDB

UniProtKB/SwissProt

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n/an/a 56n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469088
PNG
(US10807974, Example 107 | US10995088, Example 107 ...)
Show SMILES CCc1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-4-3-5-10(6-9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
PDB

UniProtKB/SwissProt

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US Patent
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TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469029
PNG
(US10807974, Example 14 | US10807974, Example 42 | ...)
Show SMILES NCc1ccc(s1)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C15H18N2O4S3/c16-11-12-6-7-15(22-12)23(18,19)13-4-3-5-14(10-13)24(20,21)17-8-1-2-9-17/h3-7,10H,1-2,8-9,11,16H2
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 56n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469029
PNG
(US10807974, Example 14 | US10807974, Example 42 | ...)
Show SMILES NCc1ccc(s1)S(=O)(=O)c1cccc(c1)S(=O)(=O)N1CCCC1
Show InChI InChI=1S/C15H18N2O4S3/c16-11-12-6-7-15(22-12)23(18,19)13-4-3-5-14(10-13)24(20,21)17-8-1-2-9-17/h3-7,10H,1-2,8-9,11,16H2
PDB

UniProtKB/SwissProt

GoogleScholar
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n/an/a 56n/an/an/an/an/an/a


TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526725
PNG
(CHEMBL4450748 | US10807974, Example 122 | US109950...)
Show SMILES CNc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C17H17N3O2S2/c1-19-14-7-13(12-5-3-2-4-6-12)8-15(9-14)24(21,22)17-11-20-16(10-18)23-17/h2-9,11,19H,10,18H2,1H3
PDB

UniProtKB/SwissProt

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n/an/a 58n/an/an/an/an/an/a


TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526725
PNG
(CHEMBL4450748 | US10807974, Example 122 | US109950...)
Show SMILES CNc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C17H17N3O2S2/c1-19-14-7-13(12-5-3-2-4-6-12)8-15(9-14)24(21,22)17-11-20-16(10-18)23-17/h2-9,11,19H,10,18H2,1H3
PDB

UniProtKB/SwissProt

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n/an/a 58n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526725
PNG
(CHEMBL4450748 | US10807974, Example 122 | US109950...)
Show SMILES CNc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C17H17N3O2S2/c1-19-14-7-13(12-5-3-2-4-6-12)8-15(9-14)24(21,22)17-11-20-16(10-18)23-17/h2-9,11,19H,10,18H2,1H3
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 58n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526740
PNG
(CHEMBL4447452 | US10807974, Example 108 | US109950...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H14N2O2S2/c17-10-15-18-11-16(21-15)22(19,20)14-8-4-7-13(9-14)12-5-2-1-3-6-12/h1-9,11H,10,17H2
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 60n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526740
PNG
(CHEMBL4447452 | US10807974, Example 108 | US109950...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H14N2O2S2/c17-10-15-18-11-16(21-15)22(19,20)14-8-4-7-13(9-14)12-5-2-1-3-6-12/h1-9,11H,10,17H2
PDB

UniProtKB/SwissProt

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n/an/a 60n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526740
PNG
(CHEMBL4447452 | US10807974, Example 108 | US109950...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C16H14N2O2S2/c17-10-15-18-11-16(21-15)22(19,20)14-8-4-7-13(9-14)12-5-2-1-3-6-12/h1-9,11H,10,17H2
PDB

UniProtKB/SwissProt

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TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469139
PNG
(US10807974, Example 158 | US10995088, Example 158 ...)
Show SMILES Cc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)C(O)=O
Show InChI InChI=1S/C17H15N3O4S2/c1-10-2-3-11(8-19-10)12-4-13(17(21)22)6-14(5-12)26(23,24)16-9-20-15(7-18)25-16/h2-6,8-9H,7,18H2,1H3,(H,21,22)
PDB

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n/an/a 64n/an/an/an/an/an/a



The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 1 hour at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469139
PNG
(US10807974, Example 158 | US10995088, Example 158 ...)
Show SMILES Cc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)C(O)=O
Show InChI InChI=1S/C17H15N3O4S2/c1-10-2-3-11(8-19-10)12-4-13(17(21)22)6-14(5-12)26(23,24)16-9-20-15(7-18)25-16/h2-6,8-9H,7,18H2,1H3,(H,21,22)
PDB

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n/an/a 64n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 1 hr at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469139
PNG
(US10807974, Example 158 | US10995088, Example 158 ...)
Show SMILES Cc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)C(O)=O
Show InChI InChI=1S/C17H15N3O4S2/c1-10-2-3-11(8-19-10)12-4-13(17(21)22)6-14(5-12)26(23,24)16-9-20-15(7-18)25-16/h2-6,8-9H,7,18H2,1H3,(H,21,22)
PDB

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TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526731
PNG
(CHEMBL4564074 | US10807974, Example 103 | US109950...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C18H18N2O2S2/c1-2-13-8-15(14-6-4-3-5-7-14)10-16(9-13)24(21,22)18-12-20-17(11-19)23-18/h3-10,12H,2,11,19H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem
US Patent
n/an/a 65n/an/an/an/an/an/a


TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526731
PNG
(CHEMBL4564074 | US10807974, Example 103 | US109950...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C18H18N2O2S2/c1-2-13-8-15(14-6-4-3-5-7-14)10-16(9-13)24(21,22)18-12-20-17(11-19)23-18/h3-10,12H,2,11,19H2,1H3
PDB

UniProtKB/SwissProt

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PC sid
UniChem
US Patent
n/an/a 65n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526731
PNG
(CHEMBL4564074 | US10807974, Example 103 | US109950...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C18H18N2O2S2/c1-2-13-8-15(14-6-4-3-5-7-14)10-16(9-13)24(21,22)18-12-20-17(11-19)23-18/h3-10,12H,2,11,19H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469115
PNG
(US10807974, Example 134 | US10995088, Example 134 ...)
Show SMILES CS(=O)(=O)c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cccc(F)c1
Show InChI InChI=1S/C17H15FN2O4S3/c1-26(21,22)14-6-12(11-3-2-4-13(18)5-11)7-15(8-14)27(23,24)17-10-20-16(9-19)25-17/h2-8,10H,9,19H2,1H3
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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 1 hr at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469115
PNG
(US10807974, Example 134 | US10995088, Example 134 ...)
Show SMILES CS(=O)(=O)c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cccc(F)c1
Show InChI InChI=1S/C17H15FN2O4S3/c1-26(21,22)14-6-12(11-3-2-4-13(18)5-11)7-15(8-14)27(23,24)17-10-20-16(9-19)25-17/h2-8,10H,9,19H2,1H3
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Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469115
PNG
(US10807974, Example 134 | US10995088, Example 134 ...)
Show SMILES CS(=O)(=O)c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cccc(F)c1
Show InChI InChI=1S/C17H15FN2O4S3/c1-26(21,22)14-6-12(11-3-2-4-13(18)5-11)7-15(8-14)27(23,24)17-10-20-16(9-19)25-17/h2-8,10H,9,19H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 1 hour at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469080
PNG
(US10807974, Example 99 | US10995088, Example 99 | ...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C14H12N2O2S2/c15-8-13-16-9-14(19-13)20(17,18)12-7-3-5-10-4-1-2-6-11(10)12/h1-7,9H,8,15H2
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Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469080
PNG
(US10807974, Example 99 | US10995088, Example 99 | ...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C14H12N2O2S2/c15-8-13-16-9-14(19-13)20(17,18)12-7-3-5-10-4-1-2-6-11(10)12/h1-7,9H,8,15H2
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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469080
PNG
(US10807974, Example 99 | US10995088, Example 99 | ...)
Show SMILES NCc1ncc(s1)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C14H12N2O2S2/c15-8-13-16-9-14(19-13)20(17,18)12-7-3-5-10-4-1-2-6-11(10)12/h1-7,9H,8,15H2
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526722
PNG
(CHEMBL4457897)
Show SMILES Cn1cc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)S(C)(=O)=O
Show InChI InChI=1S/C15H16N4O4S3/c1-19-9-11(7-18-19)10-3-12(25(2,20)21)5-13(4-10)26(22,23)15-8-17-14(6-16)24-15/h3-5,7-9H,6,16H2,1-2H3
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n/an/a 69n/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of human C-terminal His10-tagged LOXL2 (Met1 to Gln774 residues) expressed in mouse NS0 cells using cadaverine hydrochloride as substrate ...


J Med Chem 63: 2308-2324 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01112
BindingDB Entry DOI: 10.7270/Q2J38X0T
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM50526727
PNG
(CHEMBL4568508 | US10807974, Example 100 | US109950...)
Show SMILES CS(=O)(=O)c1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O4S3/c1-25(20,21)14-7-13(12-5-3-2-4-6-12)8-15(9-14)26(22,23)17-11-19-16(10-18)24-17/h2-9,11H,10,18H2,1H3
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University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of human C-terminal His10-tagged LOXL2 (Met1 to Gln774 residues) expressed in mouse NS0 cells using cadaverine hydrochloride as substrate ...


J Med Chem 63: 2308-2324 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01112
BindingDB Entry DOI: 10.7270/Q2J38X0T
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469094
PNG
(US10807974, Example 113 | US10995088, Example 113 ...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccc[n+]([O-])c1
Show InChI InChI=1S/C17H17N3O3S2/c1-2-12-6-14(13-4-3-5-20(21)11-13)8-15(7-12)25(22,23)17-10-19-16(9-18)24-17/h3-8,10-11H,2,9,18H2,1H3
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Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469094
PNG
(US10807974, Example 113 | US10995088, Example 113 ...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccc[n+]([O-])c1
Show InChI InChI=1S/C17H17N3O3S2/c1-2-12-6-14(13-4-3-5-20(21)11-13)8-15(7-12)25(22,23)17-10-19-16(9-18)24-17/h3-8,10-11H,2,9,18H2,1H3
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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469094
PNG
(US10807974, Example 113 | US10995088, Example 113 ...)
Show SMILES CCc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1ccc[n+]([O-])c1
Show InChI InChI=1S/C17H17N3O3S2/c1-2-12-6-14(13-4-3-5-20(21)11-13)8-15(7-12)25(22,23)17-10-19-16(9-18)24-17/h3-8,10-11H,2,9,18H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469070
PNG
(US10807974, Example 91 | US10995088, Example 91 | ...)
Show SMILES Cc1ccc(cc1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C17H16N2O2S2/c1-12-5-7-13(8-6-12)14-3-2-4-15(9-14)23(20,21)17-11-19-16(10-18)22-17/h2-9,11H,10,18H2,1H3
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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469070
PNG
(US10807974, Example 91 | US10995088, Example 91 | ...)
Show SMILES Cc1ccc(cc1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C17H16N2O2S2/c1-12-5-7-13(8-6-12)14-3-2-4-15(9-14)23(20,21)17-11-19-16(10-18)22-17/h2-9,11H,10,18H2,1H3
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Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469070
PNG
(US10807974, Example 91 | US10995088, Example 91 | ...)
Show SMILES Cc1ccc(cc1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C17H16N2O2S2/c1-12-5-7-13(8-6-12)14-3-2-4-15(9-14)23(20,21)17-11-19-16(10-18)22-17/h2-9,11H,10,18H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 1 hour at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
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Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469122
PNG
((5-((3-Methoxy-5-(1-(methoxymethyl)-1H-pyrazol-4-y...)
Show SMILES COCn1cc(cn1)-c1cc(OC)cc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C16H18N4O4S2/c1-23-10-20-9-12(7-19-20)11-3-13(24-2)5-14(4-11)26(21,22)16-8-18-15(6-17)25-16/h3-5,7-9H,6,10,17H2,1-2H3
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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 1 hr at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469097
PNG
(US10807974, Example 116 | US10995088, Example 116 ...)
Show SMILES Cn1cc(cn1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H14N4O2S2/c1-18-9-11(7-17-18)10-3-2-4-12(5-10)22(19,20)14-8-16-13(6-15)21-14/h2-5,7-9H,6,15H2,1H3
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TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469113
PNG
(US10807974, Example 132 | US10995088, Example 132 ...)
Show SMILES COc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cnn(c1)C1CC1
Show InChI InChI=1S/C17H18N4O3S2/c1-24-14-4-11(12-8-20-21(10-12)13-2-3-13)5-15(6-14)26(22,23)17-9-19-16(7-18)25-17/h4-6,8-10,13H,2-3,7,18H2,1H3
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Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469085
PNG
(US10807974, Example 104 | US10995088, Example 104 ...)
Show SMILES CCc1ccccc1S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-5-3-4-6-10(9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469097
PNG
(US10807974, Example 116 | US10995088, Example 116 ...)
Show SMILES Cn1cc(cn1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H14N4O2S2/c1-18-9-11(7-17-18)10-3-2-4-12(5-10)22(19,20)14-8-16-13(6-15)21-14/h2-5,7-9H,6,15H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 20 hours at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469113
PNG
(US10807974, Example 132 | US10995088, Example 132 ...)
Show SMILES COc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cnn(c1)C1CC1
Show InChI InChI=1S/C17H18N4O3S2/c1-24-14-4-11(12-8-20-21(10-12)13-2-3-13)5-15(6-14)26(22,23)17-9-19-16(7-18)25-17/h4-6,8-10,13H,2-3,7,18H2,1H3
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The Institute of Cancer Research: Royal Cancer Hospital

US Patent


Assay Description
LOXL2 batch is obtained from R&D systems/Bio-techne. Incubate for 1 hour at room temp on a plate shaker.


US Patent US10807974 (2020)


BindingDB Entry DOI: 10.7270/Q2TH8QS8
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469085
PNG
(US10807974, Example 104 | US10995088, Example 104 ...)
Show SMILES CCc1ccccc1S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-5-3-4-6-10(9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
PDB

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 74n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469097
PNG
(US10807974, Example 116 | US10995088, Example 116 ...)
Show SMILES Cn1cc(cn1)-c1cccc(c1)S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C14H14N4O2S2/c1-18-9-11(7-17-18)10-3-2-4-12(5-10)22(19,20)14-8-16-13(6-15)21-14/h2-5,7-9H,6,15H2,1H3
PDB

UniProtKB/SwissProt

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n/an/a 74n/an/an/an/an/an/a



THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 20 hrs at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469113
PNG
(US10807974, Example 132 | US10995088, Example 132 ...)
Show SMILES COc1cc(cc(c1)S(=O)(=O)c1cnc(CN)s1)-c1cnn(c1)C1CC1
Show InChI InChI=1S/C17H18N4O3S2/c1-24-14-4-11(12-8-20-21(10-12)13-2-3-13)5-15(6-14)26(22,23)17-9-19-16(7-18)25-17/h4-6,8-10,13H,2-3,7,18H2,1H3
PDB

UniProtKB/SwissProt

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THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL

US Patent


Assay Description
10. Incubate for 1 hr at room temp on a plate shaker, protected from light.


US Patent US10995088 (2021)


BindingDB Entry DOI: 10.7270/Q2125WSK
More data for this
Ligand-Target Pair
Lysyl oxidase homolog 2


(Homo sapiens (Human))
BDBM469085
PNG
(US10807974, Example 104 | US10995088, Example 104 ...)
Show SMILES CCc1ccccc1S(=O)(=O)c1cnc(CN)s1
Show InChI InChI=1S/C12H14N2O2S2/c1-2-9-5-3-4-6-10(9)18(15,16)12-8-14-11(7-13)17-12/h3-6,8H,2,7,13H2,1H3
PDB

UniProtKB/SwissProt

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US Patent
n/an/a 74n/an/an/an/an/an/a


TBA

Assay Description
MAO-Glo Assay Kit: Promega, Cat No. V1402MAO-A Enzyme: Promega, Cat No. V1452Clorgyline: Sigma, Cat No. M3778 (50 mg)Assay Plates:96 well white polys...


Citation and Details

BindingDB Entry DOI: 10.7270/Q25M69MF
More data for this
Ligand-Target Pair
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