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PubMed code 17127055

Compile data set for download or QSAR
Found 23 hits of Enzyme Inhibition Constant Data   
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
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199575
PNG
((1-(4-chlorophenoxy)-9-((1-methylpiperidin-4-yl)me...)
Show SMILES CN1CCC(Cn2c3ccccc3c3cc(cc(Oc4ccc(Cl)cc4)c23)C(=O)N2CCN(C)CC2)CC1
Show InChI InChI=1S/C31H35ClN4O2/c1-33-13-11-22(12-14-33)21-36-28-6-4-3-5-26(28)27-19-23(31(37)35-17-15-34(2)16-18-35)20-29(30(27)36)38-25-9-7-24(32)8-10-25/h3-10,19-20,22H,11-18,21H2,1-2H3
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n/an/a 11n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199586
PNG
(2-(4-((1-(4-chlorophenoxy)-3-(1-methylpiperazine-4...)
Show SMILES CN(C)C(=O)CN1CCC(Cn2c3ccccc3c3cc(cc(Oc4ccc(Cl)cc4)c23)C(=O)N2CCN(C)CC2)CC1
Show InChI InChI=1S/C34H40ClN5O3/c1-36(2)32(41)23-38-14-12-24(13-15-38)22-40-30-7-5-4-6-28(30)29-20-25(34(42)39-18-16-37(3)17-19-39)21-31(33(29)40)43-27-10-8-26(35)9-11-27/h4-11,20-21,24H,12-19,22-23H2,1-3H3
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n/an/a 14n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199587
PNG
((1-(4-chlorophenoxy)-9-(piperidin-4-ylmethyl)-9H-c...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CC3CCNCC3)c3ccccc3c2c1
Show InChI InChI=1S/C30H33ClN4O2/c1-33-14-16-34(17-15-33)30(36)22-18-26-25-4-2-3-5-27(25)35(20-21-10-12-32-13-11-21)29(26)28(19-22)37-24-8-6-23(31)7-9-24/h2-9,18-19,21,32H,10-17,20H2,1H3
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n/an/a 16n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199580
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoro-1-methyl...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCN(C)C[C@@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C31H34ClFN4O2/c1-34-13-15-36(16-14-34)31(38)22-17-26-25-5-3-4-6-28(25)37(19-21-11-12-35(2)20-27(21)33)30(26)29(18-22)39-24-9-7-23(32)8-10-24/h3-10,17-18,21,27H,11-16,19-20H2,1-2H3/t21-,27-/m0/s1
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n/an/a 28n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199584
PNG
((1-(4-chlorophenoxy)-9-((3-fluoro-1,2,5,6-tetrahyd...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CC3=C(F)CNCC3)c3ccccc3c2c1 |c:25|
Show InChI InChI=1S/C30H30ClFN4O2/c1-34-12-14-35(15-13-34)30(37)21-16-25-24-4-2-3-5-27(24)36(19-20-10-11-33-18-26(20)32)29(25)28(17-21)38-23-8-6-22(31)7-9-23/h2-9,16-17,33H,10-15,18-19H2,1H3
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n/an/a 43n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199577
PNG
((1-(4-chlorophenoxy)-9-(3-(piperidin-1-yl)propyl)-...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CCCN3CCCCC3)c3ccccc3c2c1
Show InChI InChI=1S/C32H37ClN4O2/c1-34-18-20-36(21-19-34)32(38)24-22-28-27-8-3-4-9-29(27)37(17-7-16-35-14-5-2-6-15-35)31(28)30(23-24)39-26-12-10-25(33)11-13-26/h3-4,8-13,22-23H,2,5-7,14-21H2,1H3
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n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199579
PNG
(1-(4-chlorophenoxy)-N-(2-(dimethylamino)ethyl)-9-(...)
Show SMILES CN(C)CCNC(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C29H32ClFN4O2/c1-34(2)14-13-33-29(36)20-15-24-23-5-3-4-6-26(23)35(18-19-11-12-32-17-25(19)31)28(24)27(16-20)37-22-9-7-21(30)8-10-22/h3-10,15-16,19,25,32H,11-14,17-18H2,1-2H3,(H,33,36)/t19-,25+/m0/s1
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n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199585
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C30H32ClFN4O2/c1-34-12-14-35(15-13-34)30(37)21-16-25-24-4-2-3-5-27(24)36(19-20-10-11-33-18-26(20)32)29(25)28(17-21)38-23-8-6-22(31)7-9-23/h2-9,16-17,20,26,33H,10-15,18-19H2,1H3/t20-,26-/m0/s1
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n/an/a 51n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199570
PNG
((1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoropiperidin...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C30H32ClFN4O2/c1-34-12-14-35(15-13-34)30(37)21-16-25-24-4-2-3-5-27(24)36(19-20-10-11-33-18-26(20)32)29(25)28(17-21)38-23-8-6-22(31)7-9-23/h2-9,16-17,20,26,33H,10-15,18-19H2,1H3/t20-,26+/m0/s1
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n/an/a 53n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199574
PNG
((1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoro-1-methyl...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCN(C)C[C@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C31H34ClFN4O2/c1-34-13-15-36(16-14-34)31(38)22-17-26-25-5-3-4-6-28(25)37(19-21-11-12-35(2)20-27(21)33)30(26)29(18-22)39-24-9-7-23(32)8-10-24/h3-10,17-18,21,27H,11-16,19-20H2,1-2H3/t21-,27+/m0/s1
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n/an/a 95n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199573
PNG
((1-(4-chlorophenoxy)-9-(piperidin-3-ylmethyl)-9H-c...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CC3CCCNC3)c3ccccc3c2c1 |w:23.24|
Show InChI InChI=1S/C30H33ClN4O2/c1-33-13-15-34(16-14-33)30(36)22-17-26-25-6-2-3-7-27(25)35(20-21-5-4-12-32-19-21)29(26)28(18-22)37-24-10-8-23(31)9-11-24/h2-3,6-11,17-18,21,32H,4-5,12-16,19-20H2,1H3
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n/an/a 107n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199581
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-1-cyclopropyl-3-f...)
Show SMILES CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCN(C[C@@H]3F)C3CC3)c3ccccc3c2c1
Show InChI InChI=1S/C33H36ClFN4O2/c1-36-14-16-37(17-15-36)33(40)23-18-28-27-4-2-3-5-30(27)39(20-22-12-13-38(21-29(22)35)25-8-9-25)32(28)31(19-23)41-26-10-6-24(34)7-11-26/h2-7,10-11,18-19,22,25,29H,8-9,12-17,20-21H2,1H3/t22-,29-/m0/s1
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n/an/a 186n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199572
PNG
(1-(4-chlorophenoxy)-N-(2-(dimethylamino)ethyl)-9-(...)
Show SMILES CN(C)CCN(C)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C30H34ClFN4O2/c1-34(2)14-15-35(3)30(37)21-16-25-24-6-4-5-7-27(24)36(19-20-12-13-33-18-26(20)32)29(25)28(17-21)38-23-10-8-22(31)9-11-23/h4-11,16-17,20,26,33H,12-15,18-19H2,1-3H3/t20-,26+/m0/s1
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n/an/a 191n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199571
PNG
(1-(4-chlorophenoxy)-N-((1-ethylpyrrolidin-2-yl)met...)
Show SMILES CCN1CCCC1CNC(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1 |w:6.7|
Show InChI InChI=1S/C32H36ClFN4O2/c1-2-37-15-5-6-24(37)18-36-32(39)22-16-27-26-7-3-4-8-29(26)38(20-21-13-14-35-19-28(21)34)31(27)30(17-22)40-25-11-9-23(33)10-12-25/h3-4,7-12,16-17,21,24,28,35H,2,5-6,13-15,18-20H2,1H3,(H,36,39)/t21-,24?,28+/m0/s1
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n/an/a 263n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199583
PNG
((1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoropiperidin...)
Show SMILES CN(C)C1CCN(C1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1 |w:3.2|
Show InChI InChI=1S/C31H34ClFN4O2/c1-35(2)23-12-14-36(19-23)31(38)21-15-26-25-5-3-4-6-28(25)37(18-20-11-13-34-17-27(20)33)30(26)29(16-21)39-24-9-7-22(32)8-10-24/h3-10,15-16,20,23,27,34H,11-14,17-19H2,1-2H3/t20-,23?,27+/m0/s1
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n/an/a 467n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199588
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES OCCN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C31H34ClFN4O3/c32-23-5-7-24(8-6-23)40-29-18-22(31(39)36-13-11-35(12-14-36)15-16-38)17-26-25-3-1-2-4-28(25)37(30(26)29)20-21-9-10-34-19-27(21)33/h1-8,17-18,21,27,34,38H,9-16,19-20H2/t21-,27-/m0/s1
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n/an/a 832n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199589
PNG
((1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoropiperidin...)
Show SMILES F[C@@H]1CNCC[C@H]1Cn1c2ccccc2c2cc(cc(Oc3ccc(Cl)cc3)c12)C(=O)N1CCN(CC1)C1CC1
Show InChI InChI=1S/C32H34ClFN4O2/c33-23-5-9-25(10-6-23)40-30-18-22(32(39)37-15-13-36(14-16-37)24-7-8-24)17-27-26-3-1-2-4-29(26)38(31(27)30)20-21-11-12-35-19-28(21)34/h1-6,9-10,17-18,21,24,28,35H,7-8,11-16,19-20H2/t21-,28+/m0/s1
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n/an/a 871n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199590
PNG
(1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoropiperidin-...)
Show SMILES CN1CCCC1CCNC(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1 |w:5.6|
Show InChI InChI=1S/C32H36ClFN4O2/c1-37-16-4-5-24(37)13-15-36-32(39)22-17-27-26-6-2-3-7-29(26)38(20-21-12-14-35-19-28(21)34)31(27)30(18-22)40-25-10-8-23(33)9-11-25/h2-3,6-11,17-18,21,24,28,35H,4-5,12-16,19-20H2,1H3,(H,36,39)/t21-,24?,28+/m0/s1
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n/an/a 1.86E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199578
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES F[C@H]1CNCC[C@H]1Cn1c2ccccc2c2cc(cc(Oc3ccc(Cl)cc3)c12)C(=O)N1CCn2ccnc2C1
Show InChI InChI=1S/C31H29ClFN5O2/c32-22-5-7-23(8-6-22)40-28-16-21(31(39)37-14-13-36-12-11-35-29(36)19-37)15-25-24-3-1-2-4-27(24)38(30(25)28)18-20-9-10-34-17-26(20)33/h1-8,11-12,15-16,20,26,34H,9-10,13-14,17-19H2/t20-,26-/m0/s1
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n/an/a 1.91E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199582
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES F[C@H]1CNCC[C@H]1Cn1c2ccccc2c2cc(cc(Oc3ccc(Cl)cc3)c12)C(=O)N1CCc2nc[nH]c2C1
Show InChI InChI=1S/C31H29ClFN5O2/c32-21-5-7-22(8-6-21)40-29-14-20(31(39)37-12-10-26-27(17-37)36-18-35-26)13-24-23-3-1-2-4-28(23)38(30(24)29)16-19-9-11-34-15-25(19)33/h1-8,13-14,18-19,25,34H,9-12,15-17H2,(H,35,36)/t19-,25-/m0/s1
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n/an/a 2.88E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199591
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES OC1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C30H31ClFN3O3/c31-21-5-7-23(8-6-21)38-28-16-20(30(37)34-13-10-22(36)11-14-34)15-25-24-3-1-2-4-27(24)35(29(25)28)18-19-9-12-33-17-26(19)32/h1-8,15-16,19,22,26,33,36H,9-14,17-18H2/t19-,26-/m0/s1
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n/an/a 7.76E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199576
PNG
((1-(4-chlorophenoxy)-9-(((3R,4S)-3-fluoropiperidin...)
Show SMILES F[C@H]1CNCC[C@H]1Cn1c2ccccc2c2cc(cc(Oc3ccc(Cl)cc3)c12)C(=O)N1CCN(CC(F)(F)F)CC1
Show InChI InChI=1S/C31H31ClF4N4O2/c32-22-5-7-23(8-6-22)42-28-16-21(30(41)39-13-11-38(12-14-39)19-31(34,35)36)15-25-24-3-1-2-4-27(24)40(29(25)28)18-20-9-10-37-17-26(20)33/h1-8,15-16,20,26,37H,9-14,17-19H2/t20-,26-/m0/s1
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n/an/a 9.77E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50199569
PNG
(1-(4-chlorophenoxy)-9-(((3S,4S)-3-fluoropiperidin-...)
Show SMILES CN(C)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(C[C@@H]3CCNC[C@H]3F)c3ccccc3c2c1
Show InChI InChI=1S/C27H27ClFN3O2/c1-31(2)27(33)18-13-22-21-5-3-4-6-24(21)32(16-17-11-12-30-15-23(17)29)26(22)25(14-18)34-20-9-7-19(28)8-10-20/h3-10,13-14,17,23,30H,11-12,15-16H2,1-2H3/t17-,23+/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125]peptide YY from human recombinant Y1 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 1043-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.034
BindingDB Entry DOI: 10.7270/Q20C4VDN
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%