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Compile Data Set for Download or QSAR

Found 12 hits with Last Name = 'sgarzi' and Initial = 'f'   
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
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095155
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C34H38N6O5/c35-26(17-22-12-14-24(41)15-13-22)34(45)40-16-6-11-30(40)33(44)39-29(19-23-20-37-27-10-5-4-9-25(23)27)32(43)38-28(31(36)42)18-21-7-2-1-3-8-21/h1-5,7-10,12-15,20,26,28-30,37,41H,6,11,16-19,35H2,(H2,36,42)(H,38,43)(H,39,44)/t26-,28-,29-,30-/m0/s1
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0.160n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM21015
PNG
((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095151
PNG
((S)-2-[(S)-2-(2-{1-[(S)-2-Amino-3-((S)-4-hydroxy-p...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-9-25(41)20-32(43)39-31(19-24-21-38-29-11-5-4-10-27(24)29)34(45)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-8,10-15,21,25,28,30-31,38,42H,6,9,16-20,36H2,(H2,37,44)(H,39,43)(H,40,45)/t25-,28-,30-,31-/m0/s1
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2.10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095154
PNG
((S)-2-[(S)-2-(2-{1-[(R)-2-Amino-3-((S)-4-hydroxy-p...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@@H]1CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-9-25(41)20-32(43)39-31(19-24-21-38-29-11-5-4-10-27(24)29)34(45)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-8,10-15,21,25,28,30-31,38,42H,6,9,16-20,36H2,(H2,37,44)(H,39,43)(H,40,45)/t25-,28+,30+,31+/m1/s1
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67n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50114009
PNG
(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-pyrroli...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-11-31(41)34(45)39-25(19-24-21-38-29-10-5-4-9-27(24)29)20-32(43)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-10,12-15,21,25,28,30-31,38,42H,6,11,16-20,36H2,(H2,37,44)(H,39,45)(H,40,43)/t25-,28-,30-,31-/m0/s1
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73n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50114010
PNG
(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-pyrroli...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)Cc1ccccc1
Show InChI InChI=1S/C35H40N6O5/c36-28(18-23-12-14-26(42)15-13-23)35(46)41-16-6-11-31(41)34(45)40-30(19-24-21-38-29-10-5-4-9-27(24)29)33(44)39-25(20-32(37)43)17-22-7-2-1-3-8-22/h1-5,7-10,12-15,21,25,28,30-31,38,42H,6,11,16-20,36H2,(H2,37,43)(H,39,44)(H,40,45)/t25-,28-,30-,31-/m0/s1
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79n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 by displacing [3H]DAMGO in rat brain membranes.


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095155
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C34H38N6O5/c35-26(17-22-12-14-24(41)15-13-22)34(45)40-16-6-11-30(40)33(44)39-29(19-23-20-37-27-10-5-4-9-25(23)27)32(43)38-28(31(36)42)18-21-7-2-1-3-8-21/h1-5,7-10,12-15,20,26,28-30,37,41H,6,11,16-19,35H2,(H2,36,42)(H,38,43)(H,39,44)/t26-,28-,29-,30-/m0/s1
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n/an/a 0.5n/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095151
PNG
((S)-2-[(S)-2-(2-{1-[(S)-2-Amino-3-((S)-4-hydroxy-p...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-9-25(41)20-32(43)39-31(19-24-21-38-29-11-5-4-10-27(24)29)34(45)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-8,10-15,21,25,28,30-31,38,42H,6,9,16-20,36H2,(H2,37,44)(H,39,43)(H,40,45)/t25-,28-,30-,31-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM21015
PNG
((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1
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n/an/a 9.90n/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50114009
PNG
(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-pyrroli...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(N)=O)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-11-31(41)34(45)39-25(19-24-21-38-29-10-5-4-9-27(24)29)20-32(43)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-10,12-15,21,25,28,30-31,38,42H,6,11,16-20,36H2,(H2,37,44)(H,39,45)(H,40,43)/t25-,28-,30-,31-/m0/s1
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n/an/a 23.3n/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50095154
PNG
((S)-2-[(S)-2-(2-{1-[(R)-2-Amino-3-((S)-4-hydroxy-p...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@@H]1CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C35H40N6O5/c36-28(17-23-12-14-26(42)15-13-23)35(46)41-16-6-9-25(41)20-32(43)39-31(19-24-21-38-29-11-5-4-10-27(24)29)34(45)40-30(33(37)44)18-22-7-2-1-3-8-22/h1-5,7-8,10-15,21,25,28,30-31,38,42H,6,9,16-20,36H2,(H2,37,44)(H,39,43)(H,40,45)/t25-,28+,30+,31+/m1/s1
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n/an/a 79n/an/an/an/an/an/a



Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50114010
PNG
(1-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-pyrroli...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(N)=O)Cc1ccccc1
Show InChI InChI=1S/C35H40N6O5/c36-28(18-23-12-14-26(42)15-13-23)35(46)41-16-6-11-31(41)34(45)40-30(19-24-21-38-29-10-5-4-9-27(24)29)33(44)39-25(20-32(37)43)17-22-7-2-1-3-8-22/h1-5,7-10,12-15,21,25,28,30-31,38,42H,6,11,16-20,36H2,(H2,37,43)(H,39,44)(H,40,45)/t25-,28-,30-,31-/m0/s1
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Universit£ degli Studi di Bologna

Curated by ChEMBL


Assay Description
Inhibitory activity against [3H]DAMGO binding to Opioid receptor mu 1 in rat brain membranes


J Med Chem 45: 2571-8 (2002)


BindingDB Entry DOI: 10.7270/Q20R9Q43
More data for this
Ligand-Target Pair