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Compile Data Set for Download or QSAR

Found 178 hits with Last Name = 'rafferty' and Initial = 'mf'   
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
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM83449
PNG
(1-(1-phenylcyclohexyl)piperidine;hydrochloride | M...)
Show SMILES C1CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2
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91n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity to sigma site of Phencyclidine receptor by displacement of [3H]-(+)-SKF- 10,047


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM83449
PNG
(1-(1-phenylcyclohexyl)piperidine;hydrochloride | M...)
Show SMILES C1CCN(CC1)C1(CCCCC1)c1ccccc1
Show InChI InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2
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530n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity to sigma site of Phencyclidine receptor by displacement of [3H]-(+)-SKF- 10,047


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM50405724
PNG
(CHEMBL1169565)
Show SMILES C1C2CC(CC12)[C@H](N1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C18H25N/c1-3-7-14(8-4-1)18(19-9-5-2-6-10-19)17-12-15-11-16(15)13-17/h1,3-4,7-8,15-18H,2,5-6,9-13H2/t15?,16?,17?,18-/m1/s1
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630n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity of compound against Phencyclidine receptor by displacement of [3H]TCP


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM50405723
PNG
(CHEMBL1169564)
Show SMILES C1C2CC(CC12)[C@@H](N1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C18H25N/c1-3-7-14(8-4-1)18(19-9-5-2-6-10-19)17-12-15-11-16(15)13-17/h1,3-4,7-8,15-18H,2,5-6,9-13H2/t15?,16?,17?,18-/m0/s1
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680n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity of compound against Phencyclidine receptor by displacement of [3H]TCP


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM50405723
PNG
(CHEMBL1169564)
Show SMILES C1C2CC(CC12)[C@@H](N1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C18H25N/c1-3-7-14(8-4-1)18(19-9-5-2-6-10-19)17-12-15-11-16(15)13-17/h1,3-4,7-8,15-18H,2,5-6,9-13H2/t15?,16?,17?,18-/m0/s1
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2.60E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity to sigma site of Phencyclidine receptor by displacement of [3H]-(+)-SKF- 10,047


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2C


(Rattus norvegicus (Rat))
BDBM50405724
PNG
(CHEMBL1169565)
Show SMILES C1C2CC(CC12)[C@H](N1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C18H25N/c1-3-7-14(8-4-1)18(19-9-5-2-6-10-19)17-12-15-11-16(15)13-17/h1,3-4,7-8,15-18H,2,5-6,9-13H2/t15?,16?,17?,18-/m1/s1
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3.20E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes, Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity to sigma site of Phencyclidine receptor by displacement of [3H]-(+)-SKF- 10,047


J Med Chem 31: 1571-5 (1988)


BindingDB Entry DOI: 10.7270/Q2WD41S2
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028651
PNG
(1-Aminomethyl-cycloundecanol | CHEMBL18707)
Show SMILES NCC1(O)CCCCCCCCCC1
Show InChI InChI=1S/C12H25NO/c13-11-12(14)9-7-5-3-1-2-4-6-8-10-12/h14H,1-11,13H2
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3.56E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory activity against bovine adrenal norepinephrine N-methyltransferase using phenylethanolamine as substrate


J Med Chem 25: 1250-2 (1983)


BindingDB Entry DOI: 10.7270/Q2TB15X2
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50404749
PNG
(CHEMBL2092756)
Show SMILES NC[C@]1(O)CCC2CCCCC2C1 |r|
Show InChI InChI=1S/C11H21NO/c12-8-11(13)6-5-9-3-1-2-4-10(9)7-11/h9-10,13H,1-8,12H2/t9?,10?,11-/m0/s1
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3.80E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory activity against bovine adrenal norepinephrine N-methyltransferase using phenylethanolamine as substrate


J Med Chem 25: 1250-2 (1983)


BindingDB Entry DOI: 10.7270/Q2TB15X2
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50404750
PNG
(CHEMBL2093025)
Show SMILES NC[C@@]1(O)CCC2CCCCC2C1 |r|
Show InChI InChI=1S/C11H21NO/c12-8-11(13)6-5-9-3-1-2-4-10(9)7-11/h9-10,13H,1-8,12H2/t9?,10?,11-/m1/s1
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5.63E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory activity against bovine adrenal norepinephrine N-methyltransferase using phenylethanolamine as substrate


J Med Chem 25: 1250-2 (1983)


BindingDB Entry DOI: 10.7270/Q2TB15X2
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028630
PNG
(2-Cyclohexyl-1-methyl-ethylamine | CHEMBL19683)
Show SMILES C[C@H](N)CC1CCCCC1
Show InChI InChI=1S/C9H19N/c1-8(10)7-9-5-3-2-4-6-9/h8-9H,2-7,10H2,1H3/t8-/m0/s1
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2.20E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50367056
PNG
(CHEMBL1907935)
Show SMILES N[C@@H](CO)CC1CCCCC1 |r|
Show InChI InChI=1S/C9H19NO/c10-9(7-11)6-8-4-2-1-3-5-8/h8-9,11H,1-7,10H2/t9-/m1/s1
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3.30E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028633
PNG
(2-Cyclooctyl-1-methyl-ethylamine | CHEMBL275869)
Show SMILES C[C@H](N)CC1CCCCCCC1
Show InChI InChI=1S/C11H23N/c1-10(12)9-11-7-5-3-2-4-6-8-11/h10-11H,2-9,12H2,1H3/t10-/m0/s1
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3.40E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028627
PNG
(2-Cyclohexyl-ethylamine | CHEMBL19428)
Show SMILES NCCC1CCCCC1
Show InChI InChI=1S/C8H17N/c9-7-6-8-4-2-1-3-5-8/h8H,1-7,9H2
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4.10E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028637
PNG
(1-Cyclohexyl-ethylamine | CHEMBL19424)
Show SMILES C[C@H](N)C1CCCCC1
Show InChI InChI=1S/C8H17N/c1-7(9)8-5-3-2-4-6-8/h7-8H,2-6,9H2,1H3/t7-/m0/s1
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4.40E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028643
PNG
((+/-)2-Amino-3-cyclohexyl-propan-1-ol | (R)2-Amino...)
Show SMILES NC(CO)CC1CCCCC1
Show InChI InChI=1S/C9H19NO/c10-9(7-11)6-8-4-2-1-3-5-8/h8-9,11H,1-7,10H2
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4.70E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028632
PNG
(2-Cyclooctyl-1-methyl-ethylamine | CHEMBL278330)
Show SMILES CC(N)CC1CCCCCCC1
Show InChI InChI=1S/C11H23N/c1-10(12)9-11-7-5-3-2-4-6-8-11/h10-11H,2-9,12H2,1H3
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8.60E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50367059
PNG
(CHEMBL1907936)
Show SMILES N[C@@H](CO)c1ccccc1 |r|
Show InChI InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2/t8-/m0/s1
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8.80E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023172
PNG
(1-Biphenyl-3-yl-ethylamine | CHEMBL276092)
Show SMILES CC(N)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C14H15N/c1-11(15)13-8-5-9-14(10-13)12-6-3-2-4-7-12/h2-11H,15H2,1H3
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8.90E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) value for Norepinephrine N-methyltransferase was calculated


J Med Chem 25: 1204-8 (1983)


BindingDB Entry DOI: 10.7270/Q2Z31XPV
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028635
PNG
(2-Cyclohexyl-1-methyl-ethylamine | CHEMBL277024)
Show SMILES CC(N)CC1CCCCC1
Show InChI InChI=1S/C9H19N/c1-8(10)7-9-5-3-2-4-6-9/h8-9H,2-7,10H2,1H3
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1.09E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028634
PNG
(2-Cyclohex-3-enyl-1-methyl-ethylamine | CHEMBL2837...)
Show SMILES CC(N)CC1CCC=CC1 |c:7|
Show InChI InChI=1S/C9H17N/c1-8(10)7-9-5-3-2-4-6-9/h2-3,8-9H,4-7,10H2,1H3
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1.10E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50367060
PNG
(CHEMBL1231778)
Show SMILES N[C@H](CO)CC1CCCCC1 |r|
Show InChI InChI=1S/C9H19NO/c10-9(7-11)6-8-4-2-1-3-5-8/h8-9,11H,1-7,10H2/t9-/m0/s1
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1.25E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028638
PNG
((-)-alpha-phenethylamine | (1S)-1-phenylethanamine...)
Show SMILES C[C@H](N)c1ccccc1 |r|
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1
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1.49E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028638
PNG
((-)-alpha-phenethylamine | (1S)-1-phenylethanamine...)
Show SMILES C[C@H](N)c1ccccc1 |r|
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1
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1.49E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028629
PNG
(2-Cyclooctyl-1-methyl-ethylamine | CHEMBL19161)
Show SMILES C[C@@H](N)CC1CCCCCCC1
Show InChI InChI=1S/C11H23N/c1-10(12)9-11-7-5-3-2-4-6-8-11/h10-11H,2-9,12H2,1H3/t10-/m1/s1
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1.57E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028640
PNG
(2-Biphenyl-4-yl-1-methyl-ethylamine | CHEMBL279879)
Show SMILES CC(N)Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C15H17N/c1-12(16)11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,12H,11,16H2,1H3
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2.62E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) value for Norepinephrine N-methyltransferase was calculated


J Med Chem 25: 1204-8 (1983)


BindingDB Entry DOI: 10.7270/Q2Z31XPV
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028636
PNG
(2-Cyclohexyl-1-methyl-ethylamine | CHEMBL19716)
Show SMILES C[C@@H](N)CC1CCCCC1
Show InChI InChI=1S/C9H19N/c1-8(10)7-9-5-3-2-4-6-9/h8-9H,2-7,10H2,1H3/t8-/m1/s1
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2.90E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50367057
PNG
(CHEMBL1235200 | EN300-73161)
Show SMILES N[C@@H](CO)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m1/s1
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3.79E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028644
PNG
((+/-)2-Amino-3-phenyl-propan-1-ol | (R)2-Amino-3-p...)
Show SMILES NC(CO)Cc1ccccc1
Show InChI InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2
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3.85E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028631
PNG
(1-Cyclohexyl-ethylamine | CHEMBL19290)
Show SMILES C[C@@H](N)C1CCCCC1
Show InChI InChI=1S/C8H17N/c1-7(9)8-5-3-2-4-6-8/h7-8H,2-6,9H2,1H3/t7-/m1/s1
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4.12E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50022723
PNG
((+)-(S)-amphetamine | (+)-alpha-methylphenethylami...)
Show SMILES C[C@H](N)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1
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4.42E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023171
PNG
(1-amino-1-phenylethane | 1-phenethylamine | 1-phen...)
Show SMILES CC(N)c1ccccc1
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3
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4.60E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023171
PNG
(1-amino-1-phenylethane | 1-phenethylamine | 1-phen...)
Show SMILES CC(N)c1ccccc1
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3
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4.60E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023171
PNG
(1-amino-1-phenylethane | 1-phenethylamine | 1-phen...)
Show SMILES CC(N)c1ccccc1
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3
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4.60E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) value for Norepinephrine N-methyltransferase was calculated


J Med Chem 25: 1204-8 (1983)


BindingDB Entry DOI: 10.7270/Q2Z31XPV
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM10758
PNG
(14C-phenylethylamine | 2-phenylethan-1-amine | CHE...)
Show SMILES NCCc1ccccc1
Show InChI InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
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4.67E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50367058
PNG
(CHEMBL1235287)
Show SMILES N[C@H](CO)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2/t9-/m0/s1
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6.64E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023169
PNG
(1-Biphenyl-4-yl-ethylamine | CHEMBL19081)
Show SMILES CC(N)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C14H15N/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11H,15H2,1H3
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7.37E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) value for Norepinephrine N-methyltransferase was calculated


J Med Chem 25: 1204-8 (1983)


BindingDB Entry DOI: 10.7270/Q2Z31XPV
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50005246
PNG
(1-Phenylpropan-2-amin | 1-phenyl-2-aminopropane | ...)
Show SMILES CC(N)Cc1ccccc1
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
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7.40E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50005246
PNG
(1-Phenylpropan-2-amin | 1-phenyl-2-aminopropane | ...)
Show SMILES CC(N)Cc1ccccc1
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
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7.40E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50005246
PNG
(1-Phenylpropan-2-amin | 1-phenyl-2-aminopropane | ...)
Show SMILES CC(N)Cc1ccccc1
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
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7.40E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) value for Norepinephrine N-methyltransferase was calculated


J Med Chem 25: 1204-8 (1983)


BindingDB Entry DOI: 10.7270/Q2Z31XPV
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028642
PNG
(1-Benzyl-butylamine | CHEMBL25435)
Show SMILES CCCC(N)Cc1ccccc1
Show InChI InChI=1S/C11H17N/c1-2-6-11(12)9-10-7-4-3-5-8-10/h3-5,7-8,11H,2,6,9,12H2,1H3
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>1.00E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028649
PNG
(1-Benzyl-propylamine | CHEMBL21360)
Show SMILES CCC(N)Cc1ccccc1
Show InChI InChI=1S/C10H15N/c1-2-10(11)8-9-6-4-3-5-7-9/h3-7,10H,2,8,11H2,1H3
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>1.00E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028645
PNG
(1-Benzyl-2-phenyl-ethylamine | CHEMBL25434)
Show SMILES NC(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C15H17N/c16-15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10,15H,11-12,16H2
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>1.00E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028646
PNG
(1-Phenyl-butylamine | CHEMBL22934)
Show SMILES CCCC(N)c1ccccc1
Show InChI InChI=1S/C10H15N/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8,10H,2,6,11H2,1H3
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>1.00E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028648
PNG
(2-Cyclohexyl-1-phenyl-ethylamine | CHEMBL22863)
Show SMILES NC(CC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C14H21N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h2,5-6,9-10,12,14H,1,3-4,7-8,11,15H2
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>1.00E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028647
PNG
((+/-)2-Amino-2-phenyl-ethanol | (R)2-Amino-2-pheny...)
Show SMILES NC(CO)c1ccccc1
Show InChI InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2
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1.22E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50022723
PNG
((+)-(S)-amphetamine | (+)-alpha-methylphenethylami...)
Show SMILES C[C@H](N)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1
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1.38E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50022723
PNG
((+)-(S)-amphetamine | (+)-alpha-methylphenethylami...)
Show SMILES C[C@H](N)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1
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1.38E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50022721
PNG
((R)-amphetamine | AMPHETAMINE | CHEMBL19393)
Show SMILES C[C@@H](N)Cc1ccccc1 |r|
Show InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m1/s1
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1.38E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028628
PNG
((1R)-1-phenylethanamine | (R)-alpha-methylbenzenem...)
Show SMILES C[C@@H](N)c1ccccc1 |r|
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m1/s1
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1.68E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine adrenal norepinephrine N-methyl-transferase was determined


J Med Chem 25: 1248-50 (1983)


BindingDB Entry DOI: 10.7270/Q2S46SJ3
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028628
PNG
((1R)-1-phenylethanamine | (R)-alpha-methylbenzenem...)
Show SMILES C[C@@H](N)c1ccccc1 |r|
Show InChI InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m1/s1
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1.68E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against Norepinephrine N-methyltransferase of bovine adrenal glands


J Med Chem 25: 1198-204 (1983)


BindingDB Entry DOI: 10.7270/Q22V2F57
More data for this
Ligand-Target Pair
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