Found 24 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | KEGG
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Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114973
(CHEMBL51542 | N-(4-{[(Naphthalen-2-ylmethyl)-amino...)Show SMILES FC(F)(F)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccc3ccccc3c2)CC1 |wU:15.15,wD:18.19,(-6.68,-.35,;-5.32,-1.12,;-3.83,-1.52,;-3.99,-.35,;-5.32,-2.67,;-6.66,-3.44,;-6.66,-4.99,;-5.32,-5.75,;-3.99,-4.98,;-3.99,-3.44,;-2.66,-2.65,;-2.24,-4.14,;-2.66,-1.11,;-1.3,-3.41,;.03,-2.64,;1.36,-3.41,;2.7,-2.63,;4.03,-3.4,;4.03,-4.94,;5.36,-5.71,;6.69,-4.94,;8.05,-5.71,;9.38,-4.94,;9.36,-3.41,;10.72,-2.64,;12.05,-3.41,;13.38,-2.65,;14.69,-3.41,;14.69,-4.96,;13.36,-5.73,;12.03,-4.96,;10.72,-5.71,;2.7,-5.71,;1.36,-4.96,)| Show InChI InChI=1S/C26H29F3N2O2S/c27-26(28,29)24-7-3-4-8-25(24)34(32,33)31-18-20-11-9-19(10-12-20)16-30-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,13-15,19-20,30-31H,9-12,16-18H2/t19-,20- | KEGG
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Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50403914
(CHEMBL2113711)Show SMILES Nc1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:12.12,wD:15.16,(-.51,-.5,;-.51,-2.04,;-1.84,-2.81,;-1.84,-4.36,;-.51,-5.13,;.84,-4.36,;.84,-2.81,;2.17,-2.03,;2.16,-.49,;2.58,-3.52,;3.52,-2.79,;4.85,-2.02,;6.18,-2.79,;7.51,-2.01,;8.85,-2.78,;8.85,-4.33,;10.19,-5.1,;11.53,-4.33,;12.87,-5.1,;14.2,-4.33,;14.19,-2.79,;15.53,-2.02,;16.87,-2.79,;18.2,-2.04,;19.52,-2.81,;19.51,-4.35,;18.18,-5.11,;16.86,-4.33,;15.53,-5.11,;7.51,-5.1,;6.18,-4.33,)| Show InChI InChI=1S/C25H35N3O2S/c26-24-7-3-4-8-25(24)31(29,30)28-18-20-11-9-19(10-12-20)16-27-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,27-28H,9-18,26H2/t19-,20-,21? | KEGG
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| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114977
(CHEMBL51884 | Naphthalene-1-sulfonic acid (4-{[(1,...)Show SMILES O=S(=O)(NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1)c1cccc2ccccc12 |wU:5.4,wD:8.8,(-1.14,-3.49,;-1.56,-2,;-1.56,-.45,;-.2,-2.77,;1.13,-2,;2.46,-2.76,;3.8,-1.97,;5.13,-2.74,;5.13,-4.29,;6.46,-5.06,;7.79,-4.29,;9.15,-5.06,;10.48,-4.29,;10.46,-2.76,;11.82,-1.99,;13.15,-2.77,;14.48,-2.01,;15.79,-2.77,;15.79,-4.31,;14.46,-5.08,;13.12,-4.3,;11.82,-5.07,;3.8,-5.06,;2.46,-4.3,;-2.89,-2.78,;-2.87,-4.31,;-4.2,-5.1,;-5.56,-4.33,;-5.56,-2.79,;-6.89,-2.02,;-6.89,-.5,;-5.56,.28,;-4.22,-.48,;-4.22,-2.02,)| Show InChI InChI=1S/C29H36N2O2S/c32-34(33,29-11-5-9-26-7-3-4-10-28(26)29)31-21-23-14-12-22(13-15-23)19-30-20-24-16-17-25-6-1-2-8-27(25)18-24/h1-11,22-24,30-31H,12-21H2/t22-,23-,24? | KEGG
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Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114979
(CHEMBL415926 | Naphthalene-2-sulfonic acid (4-{[(1...)Show SMILES O=S(=O)(NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1)c1ccc2ccccc2c1 |wU:5.4,wD:8.8,(-1.75,.27,;-1.73,-1.27,;-1.32,-2.77,;-.39,-2.04,;.94,-1.27,;2.28,-2.04,;3.61,-1.25,;4.94,-2.02,;4.94,-3.56,;6.29,-4.33,;7.62,-3.56,;8.96,-4.33,;10.3,-3.56,;10.29,-2.04,;11.63,-1.27,;12.96,-2.04,;14.29,-1.29,;15.62,-2.04,;15.6,-3.59,;14.27,-4.36,;12.95,-3.59,;11.63,-4.36,;3.61,-4.33,;2.28,-3.59,;-3.06,-2.07,;-3.06,-3.61,;-4.41,-4.38,;-5.74,-3.61,;-7.08,-4.38,;-8.41,-3.61,;-8.41,-2.07,;-7.08,-1.29,;-5.74,-2.07,;-4.41,-1.29,)| Show InChI InChI=1S/C29H36N2O2S/c32-34(33,29-16-15-26-6-2-4-8-28(26)18-29)31-21-23-11-9-22(10-12-23)19-30-20-24-13-14-25-5-1-3-7-27(25)17-24/h1-8,15-16,18,22-24,30-31H,9-14,17,19-21H2/t22-,23-,24? | KEGG
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| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114976
(2-Nitro-N-(4-{[(quinolin-2-ylmethyl)-amino]-methyl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccc3ccccc3n2)CC1 |wU:14.14,wD:17.18,(3.83,-5.18,;2.48,-5.95,;1.15,-5.2,;2.5,-7.47,;1.17,-8.28,;1.17,-9.82,;2.5,-10.59,;3.83,-9.82,;3.83,-8.26,;5.16,-7.47,;5.56,-8.98,;5.16,-5.95,;6.49,-8.26,;7.82,-7.47,;9.17,-8.24,;10.48,-7.47,;11.83,-8.24,;11.83,-9.78,;13.17,-10.55,;14.5,-9.78,;15.83,-10.55,;17.16,-9.78,;17.16,-8.24,;18.49,-7.47,;19.83,-8.26,;21.15,-7.47,;22.48,-8.26,;22.47,-9.8,;21.14,-10.57,;19.82,-9.78,;18.49,-10.55,;10.5,-10.55,;9.17,-9.78,)| Show InChI InChI=1S/C24H28N4O4S/c29-28(30)23-7-3-4-8-24(23)33(31,32)26-16-19-11-9-18(10-12-19)15-25-17-21-14-13-20-5-1-2-6-22(20)27-21/h1-8,13-14,18-19,25-26H,9-12,15-17H2/t18-,19- | KEGG
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| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114978
(CHEMBL299295 | Naphthalene-1-sulfonic acid (4-{[2-...)Show SMILES OCC(Cc1ccc(Cl)cc1)NC[C@H]1CC[C@H](CNS(=O)(=O)c2cccc3ccccc23)CC1 |wU:16.17,wD:13.13,(6.46,-5.19,;7.82,-4.42,;7.79,-2.88,;9.15,-2.1,;10.48,-2.88,;11.82,-2.1,;13.15,-2.86,;13.15,-4.42,;14.48,-5.19,;11.82,-5.19,;10.48,-4.42,;6.46,-2.1,;5.13,-2.88,;3.8,-2.11,;3.8,-.57,;2.46,.2,;1.13,-.58,;-.2,.19,;-1.54,-.58,;-2.89,.18,;-2.96,-1.27,;-2.89,1.72,;-4.22,-.61,;-4.22,-2.15,;-5.56,-2.92,;-6.89,-2.16,;-6.89,-.61,;-8.22,.14,;-8.22,1.68,;-6.89,2.46,;-5.56,1.7,;-5.56,.16,;1.13,-2.13,;2.46,-2.88,)| Show InChI InChI=1S/C27H33ClN2O3S/c28-24-14-12-20(13-15-24)16-25(19-31)29-17-21-8-10-22(11-9-21)18-30-34(32,33)27-7-3-5-23-4-1-2-6-26(23)27/h1-7,12-15,21-22,25,29-31H,8-11,16-19H2/t21-,22-,25? | KEGG
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Rat 6B) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | UniProtKB/SwissProt
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Functional response of NPY to inhibit forskolin-stimulated cAMP in cells stably transfected with rat Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114981
(CHEMBL51874 | N-(4-{[(Naphthalen-1-ylmethyl)-amino...)Show SMILES FC(F)(F)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2cccc3ccccc23)CC1 |wU:15.15,wD:18.19,(-2.91,-.38,;-4.25,-1.15,;-5.58,-.41,;-2.75,-1.55,;-4.22,-2.7,;-5.56,-3.49,;-5.56,-5.03,;-4.22,-5.81,;-2.89,-5.03,;-2.89,-3.47,;-1.56,-2.7,;-1.16,-4.19,;-1.56,-1.15,;-.23,-3.47,;1.11,-2.7,;2.46,-3.44,;3.77,-2.67,;5.13,-3.44,;5.13,-4.99,;6.46,-5.76,;7.79,-4.99,;9.13,-5.76,;10.46,-4.99,;10.46,-3.44,;11.79,-2.67,;13.12,-3.47,;13.12,-4.99,;14.43,-5.76,;14.46,-7.28,;13.12,-8.05,;11.79,-7.28,;11.79,-5.76,;3.8,-5.76,;2.46,-4.99,)| Show InChI InChI=1S/C26H29F3N2O2S/c27-26(28,29)24-10-3-4-11-25(24)34(32,33)31-17-20-14-12-19(13-15-20)16-30-18-22-8-5-7-21-6-1-2-9-23(21)22/h1-11,19-20,30-31H,12-18H2/t19-,20- | KEGG
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114980
(2-Nitro-N-(4-{[(quinolin-4-ylmethyl)-amino]-methyl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccnc3ccccc23)CC1 |wU:14.14,wD:17.18,(-2.1,1.7,;-3.45,.9,;-4.77,1.68,;-3.45,-.64,;-4.77,-1.41,;-4.76,-2.95,;-3.45,-3.73,;-2.1,-2.95,;-2.1,-1.41,;-.76,-.62,;-.35,-2.11,;-.77,.93,;.58,-1.39,;1.92,-.62,;3.25,-1.39,;4.57,-.59,;5.92,-1.36,;5.92,-2.91,;7.26,-3.68,;8.59,-2.91,;9.94,-3.68,;11.27,-2.91,;11.25,-1.39,;12.6,-.62,;13.94,-1.39,;13.92,-2.91,;15.24,-3.68,;15.27,-5.2,;13.94,-5.97,;12.6,-5.22,;12.6,-3.68,;4.57,-3.68,;3.25,-2.93,)| Show InChI InChI=1S/C24H28N4O4S/c29-28(30)23-7-3-4-8-24(23)33(31,32)27-16-19-11-9-18(10-12-19)15-25-17-20-13-14-26-22-6-2-1-5-21(20)22/h1-8,13-14,18-19,25,27H,9-12,15-17H2/t18-,19- | KEGG
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| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity of the compound against cloned human Dopamine receptor D2 was evaluated |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Alpha-2C adrenergic receptor
(Homo sapiens (Human)) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | PDB
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| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Bnding affinity of the compound against cloned human Alpha-2C adrenergic receptor was evaluated |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 5
(Homo sapiens (Human)) | BDBM50114975
(CHEMBL48777 | Naphthalene-2-sulfonic acid {6-[(nap...)Show SMILES O=S(=O)(NCCCCCCNCc1ccc2ccccc2c1)c1ccc2ccccc2c1 Show InChI InChI=1S/C27H30N2O2S/c30-32(31,27-16-15-24-10-4-6-12-26(24)20-27)29-18-8-2-1-7-17-28-21-22-13-14-23-9-3-5-11-25(23)19-22/h3-6,9-16,19-20,28-29H,1-2,7-8,17-18,21H2 | KEGG
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 123 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 5 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114978
(CHEMBL299295 | Naphthalene-1-sulfonic acid (4-{[2-...)Show SMILES OCC(Cc1ccc(Cl)cc1)NC[C@H]1CC[C@H](CNS(=O)(=O)c2cccc3ccccc23)CC1 |wU:16.17,wD:13.13,(6.46,-5.19,;7.82,-4.42,;7.79,-2.88,;9.15,-2.1,;10.48,-2.88,;11.82,-2.1,;13.15,-2.86,;13.15,-4.42,;14.48,-5.19,;11.82,-5.19,;10.48,-4.42,;6.46,-2.1,;5.13,-2.88,;3.8,-2.11,;3.8,-.57,;2.46,.2,;1.13,-.58,;-.2,.19,;-1.54,-.58,;-2.89,.18,;-2.96,-1.27,;-2.89,1.72,;-4.22,-.61,;-4.22,-2.15,;-5.56,-2.92,;-6.89,-2.16,;-6.89,-.61,;-8.22,.14,;-8.22,1.68,;-6.89,2.46,;-5.56,1.7,;-5.56,.16,;1.13,-2.13,;2.46,-2.88,)| Show InChI InChI=1S/C27H33ClN2O3S/c28-24-14-12-20(13-15-24)16-25(19-31)29-17-21-8-10-22(11-9-21)18-30-34(32,33)27-7-3-5-23-4-1-2-6-26(23)27/h1-7,12-15,21-22,25,29-31H,8-11,16-19H2/t21-,22-,25? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| PubMed
| 3.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114977
(CHEMBL51884 | Naphthalene-1-sulfonic acid (4-{[(1,...)Show SMILES O=S(=O)(NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1)c1cccc2ccccc12 |wU:5.4,wD:8.8,(-1.14,-3.49,;-1.56,-2,;-1.56,-.45,;-.2,-2.77,;1.13,-2,;2.46,-2.76,;3.8,-1.97,;5.13,-2.74,;5.13,-4.29,;6.46,-5.06,;7.79,-4.29,;9.15,-5.06,;10.48,-4.29,;10.46,-2.76,;11.82,-1.99,;13.15,-2.77,;14.48,-2.01,;15.79,-2.77,;15.79,-4.31,;14.46,-5.08,;13.12,-4.3,;11.82,-5.07,;3.8,-5.06,;2.46,-4.3,;-2.89,-2.78,;-2.87,-4.31,;-4.2,-5.1,;-5.56,-4.33,;-5.56,-2.79,;-6.89,-2.02,;-6.89,-.5,;-5.56,.28,;-4.22,-.48,;-4.22,-2.02,)| Show InChI InChI=1S/C29H36N2O2S/c32-34(33,29-11-5-9-26-7-3-4-10-28(26)29)31-21-23-14-12-22(13-15-23)19-30-20-24-16-17-25-6-1-2-8-27(25)18-24/h1-11,22-24,30-31H,12-21H2/t22-,23-,24? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 3.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114979
(CHEMBL415926 | Naphthalene-2-sulfonic acid (4-{[(1...)Show SMILES O=S(=O)(NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1)c1ccc2ccccc2c1 |wU:5.4,wD:8.8,(-1.75,.27,;-1.73,-1.27,;-1.32,-2.77,;-.39,-2.04,;.94,-1.27,;2.28,-2.04,;3.61,-1.25,;4.94,-2.02,;4.94,-3.56,;6.29,-4.33,;7.62,-3.56,;8.96,-4.33,;10.3,-3.56,;10.29,-2.04,;11.63,-1.27,;12.96,-2.04,;14.29,-1.29,;15.62,-2.04,;15.6,-3.59,;14.27,-4.36,;12.95,-3.59,;11.63,-4.36,;3.61,-4.33,;2.28,-3.59,;-3.06,-2.07,;-3.06,-3.61,;-4.41,-4.38,;-5.74,-3.61,;-7.08,-4.38,;-8.41,-3.61,;-8.41,-2.07,;-7.08,-1.29,;-5.74,-2.07,;-4.41,-1.29,)| Show InChI InChI=1S/C29H36N2O2S/c32-34(33,29-16-15-26-6-2-4-8-28(26)18-29)31-21-23-11-9-22(10-12-23)19-30-20-24-13-14-25-5-1-3-7-27(25)17-24/h1-8,15-16,18,22-24,30-31H,9-14,17,19-21H2/t22-,23-,24? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 5.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114975
(CHEMBL48777 | Naphthalene-2-sulfonic acid {6-[(nap...)Show SMILES O=S(=O)(NCCCCCCNCc1ccc2ccccc2c1)c1ccc2ccccc2c1 Show InChI InChI=1S/C27H30N2O2S/c30-32(31,27-16-15-24-10-4-6-12-26(24)20-27)29-18-8-2-1-7-17-28-21-22-13-14-23-9-3-5-11-25(23)19-22/h3-6,9-16,19-20,28-29H,1-2,7-8,17-18,21H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 7.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114973
(CHEMBL51542 | N-(4-{[(Naphthalen-2-ylmethyl)-amino...)Show SMILES FC(F)(F)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccc3ccccc3c2)CC1 |wU:15.15,wD:18.19,(-6.68,-.35,;-5.32,-1.12,;-3.83,-1.52,;-3.99,-.35,;-5.32,-2.67,;-6.66,-3.44,;-6.66,-4.99,;-5.32,-5.75,;-3.99,-4.98,;-3.99,-3.44,;-2.66,-2.65,;-2.24,-4.14,;-2.66,-1.11,;-1.3,-3.41,;.03,-2.64,;1.36,-3.41,;2.7,-2.63,;4.03,-3.4,;4.03,-4.94,;5.36,-5.71,;6.69,-4.94,;8.05,-5.71,;9.38,-4.94,;9.36,-3.41,;10.72,-2.64,;12.05,-3.41,;13.38,-2.65,;14.69,-3.41,;14.69,-4.96,;13.36,-5.73,;12.03,-4.96,;10.72,-5.71,;2.7,-5.71,;1.36,-4.96,)| Show InChI InChI=1S/C26H29F3N2O2S/c27-26(28,29)24-7-3-4-8-25(24)34(32,33)31-18-20-11-9-19(10-12-20)16-30-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,13-15,19-20,30-31H,9-12,16-18H2/t19-,20- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114981
(CHEMBL51874 | N-(4-{[(Naphthalen-1-ylmethyl)-amino...)Show SMILES FC(F)(F)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2cccc3ccccc23)CC1 |wU:15.15,wD:18.19,(-2.91,-.38,;-4.25,-1.15,;-5.58,-.41,;-2.75,-1.55,;-4.22,-2.7,;-5.56,-3.49,;-5.56,-5.03,;-4.22,-5.81,;-2.89,-5.03,;-2.89,-3.47,;-1.56,-2.7,;-1.16,-4.19,;-1.56,-1.15,;-.23,-3.47,;1.11,-2.7,;2.46,-3.44,;3.77,-2.67,;5.13,-3.44,;5.13,-4.99,;6.46,-5.76,;7.79,-4.99,;9.13,-5.76,;10.46,-4.99,;10.46,-3.44,;11.79,-2.67,;13.12,-3.47,;13.12,-4.99,;14.43,-5.76,;14.46,-7.28,;13.12,-8.05,;11.79,-7.28,;11.79,-5.76,;3.8,-5.76,;2.46,-4.99,)| Show InChI InChI=1S/C26H29F3N2O2S/c27-26(28,29)24-10-3-4-11-25(24)34(32,33)31-17-20-14-12-19(13-15-20)16-30-18-22-8-5-7-21-6-1-2-9-23(21)22/h1-11,19-20,30-31H,12-18H2/t19-,20- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 1.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
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Patents
Similars
| PubMed
| 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50403914
(CHEMBL2113711)Show SMILES Nc1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:12.12,wD:15.16,(-.51,-.5,;-.51,-2.04,;-1.84,-2.81,;-1.84,-4.36,;-.51,-5.13,;.84,-4.36,;.84,-2.81,;2.17,-2.03,;2.16,-.49,;2.58,-3.52,;3.52,-2.79,;4.85,-2.02,;6.18,-2.79,;7.51,-2.01,;8.85,-2.78,;8.85,-4.33,;10.19,-5.1,;11.53,-4.33,;12.87,-5.1,;14.2,-4.33,;14.19,-2.79,;15.53,-2.02,;16.87,-2.79,;18.2,-2.04,;19.52,-2.81,;19.51,-4.35,;18.18,-5.11,;16.86,-4.33,;15.53,-5.11,;7.51,-5.1,;6.18,-4.33,)| Show InChI InChI=1S/C25H35N3O2S/c26-24-7-3-4-8-25(24)31(29,30)28-18-20-11-9-19(10-12-20)16-27-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,27-28H,9-18,26H2/t19-,20-,21? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.72E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(RAT) | BDBM50114974
(2-Nitro-N-(4-{[(1,2,3,4-tetrahydro-naphthalen-2-yl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCC2CCc3ccccc3C2)CC1 |wU:14.14,wD:17.18,(-3.71,-.58,;-5.05,-1.36,;-6.38,-.59,;-5.04,-2.91,;-6.38,-3.68,;-6.38,-5.24,;-5.04,-6.01,;-3.71,-5.24,;-3.71,-3.68,;-2.38,-2.9,;-2.38,-1.36,;-1.96,-4.4,;-1.03,-3.67,;.3,-2.9,;1.64,-3.66,;2.97,-2.88,;4.31,-3.65,;4.31,-5.19,;5.64,-5.96,;6.98,-5.19,;8.32,-5.96,;9.66,-5.19,;9.64,-3.66,;10.99,-2.88,;12.33,-3.67,;13.65,-2.91,;14.97,-3.67,;14.97,-5.21,;13.64,-5.99,;12.31,-5.2,;10.99,-5.97,;2.98,-5.96,;1.64,-5.2,)| Show InChI InChI=1S/C25H33N3O4S/c29-28(30)24-7-3-4-8-25(24)33(31,32)27-18-20-11-9-19(10-12-20)16-26-17-21-13-14-22-5-1-2-6-23(22)15-21/h1-8,19-21,26-27H,9-18H2/t19-,20-,21? | PDB
Reactome pathway
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Functional response of NPY to inhibit forskolin-stimulated cAMP in cells stably transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114976
(2-Nitro-N-(4-{[(quinolin-2-ylmethyl)-amino]-methyl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccc3ccccc3n2)CC1 |wU:14.14,wD:17.18,(3.83,-5.18,;2.48,-5.95,;1.15,-5.2,;2.5,-7.47,;1.17,-8.28,;1.17,-9.82,;2.5,-10.59,;3.83,-9.82,;3.83,-8.26,;5.16,-7.47,;5.56,-8.98,;5.16,-5.95,;6.49,-8.26,;7.82,-7.47,;9.17,-8.24,;10.48,-7.47,;11.83,-8.24,;11.83,-9.78,;13.17,-10.55,;14.5,-9.78,;15.83,-10.55,;17.16,-9.78,;17.16,-8.24,;18.49,-7.47,;19.83,-8.26,;21.15,-7.47,;22.48,-8.26,;22.47,-9.8,;21.14,-10.57,;19.82,-9.78,;18.49,-10.55,;10.5,-10.55,;9.17,-9.78,)| Show InChI InChI=1S/C24H28N4O4S/c29-28(30)23-7-3-4-8-24(23)33(31,32)26-16-19-11-9-18(10-12-19)15-25-17-21-14-13-20-5-1-2-6-22(20)27-21/h1-8,13-14,18-19,25-26H,9-12,15-17H2/t18-,19- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.37E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 1
(Homo sapiens (Human)) | BDBM50114980
(2-Nitro-N-(4-{[(quinolin-4-ylmethyl)-amino]-methyl...)Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)NC[C@H]1CC[C@H](CNCc2ccnc3ccccc23)CC1 |wU:14.14,wD:17.18,(-2.1,1.7,;-3.45,.9,;-4.77,1.68,;-3.45,-.64,;-4.77,-1.41,;-4.76,-2.95,;-3.45,-3.73,;-2.1,-2.95,;-2.1,-1.41,;-.76,-.62,;-.35,-2.11,;-.77,.93,;.58,-1.39,;1.92,-.62,;3.25,-1.39,;4.57,-.59,;5.92,-1.36,;5.92,-2.91,;7.26,-3.68,;8.59,-2.91,;9.94,-3.68,;11.27,-2.91,;11.25,-1.39,;12.6,-.62,;13.94,-1.39,;13.92,-2.91,;15.24,-3.68,;15.27,-5.2,;13.94,-5.97,;12.6,-5.22,;12.6,-3.68,;4.57,-3.68,;3.25,-2.93,)| Show InChI InChI=1S/C24H28N4O4S/c29-28(30)23-7-3-4-8-24(23)33(31,32)27-16-19-11-9-18(10-12-19)15-25-17-20-13-14-26-22-6-2-1-5-21(20)22/h1-8,13-14,18-19,25,27H,9-12,15-17H2/t18-,19- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 4.87E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lundbeck Research USA, Inc.
Curated by ChEMBL
| Assay Description
Tested for radioligand binding affinity against membranes from COS-7 cells transiently transfected with Neuropeptide Y receptor type 1 |
Bioorg Med Chem Lett 12: 1767-9 (2002)
BindingDB Entry DOI: 10.7270/Q2JD4W4S |
More data for this
Ligand-Target Pair | |
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