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Compile Data Set for Download or QSAR

Found 255 hits with Last Name = 'ashweek' and Initial = 'nj'   
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
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213665
PNG
((S)-1-(3-(1-(4-(1H-tetrazol-5-yl)phenethylamino)pr...)
Show SMILES C[C@H](CNCCc1ccc(cc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F |r|
Show InChI InChI=1S/C36H37F4N7O/c1-21-15-22(2)17-26(16-21)34-33(23(3)19-41-13-11-24-7-9-25(10-8-24)35-43-45-46-44-35)28-20-47(14-12-31(28)42-34)32(48)18-27-29(36(38,39)40)5-4-6-30(27)37/h4-10,15-17,23,41-42H,11-14,18-20H2,1-3H3,(H,43,44,45,46)/t23-/m1/s1
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0.200n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213671
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(quinoxalin-...)
Show SMILES C[C@H](CNCCc1ccc2nccnc2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C37H37F4N5O/c1-22-15-23(2)17-26(16-22)36-35(24(3)20-42-11-9-25-7-8-32-33(18-25)44-13-12-43-32)28-21-46(14-10-31(28)45-36)34(47)19-27-29(37(39,40)41)5-4-6-30(27)38/h4-8,12-13,15-18,24,42,45H,9-11,14,19-21H2,1-3H3/t24-/m1/s1
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0.300n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213664
PNG
((S)-5-(2-(2-(2-(3,5-dimethylphenyl)-5-(2-(2-fluoro...)
Show SMILES C[C@H](CNCCc1ccc(=O)n(C)c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C35H38F4N4O2/c1-21-14-22(2)16-25(15-21)34-33(23(3)18-40-12-10-24-8-9-31(44)42(4)19-24)27-20-43(13-11-30(27)41-34)32(45)17-26-28(35(37,38)39)6-5-7-29(26)36/h5-9,14-16,19,23,40-41H,10-13,17-18,20H2,1-4H3/t23-/m1/s1
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0.400n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213659
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C34H36F4N4O/c1-21-15-22(2)17-25(16-21)33-32(23(3)19-40-13-9-24-7-11-39-12-8-24)27-20-42(14-10-30(27)41-33)31(43)18-26-28(34(36,37)38)5-4-6-29(26)35/h4-8,11-12,15-17,23,40-41H,9-10,13-14,18-20H2,1-3H3/t23-/m1/s1
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0.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213658
PNG
((S)-1-(3-(1-(2-(1H-benzo[d][1,2,3]triazol-5-yl)eth...)
Show SMILES C[C@H](CNCCc1ccc2nn[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C35H36F4N6O/c1-20-13-21(2)15-24(14-20)34-33(22(3)18-40-11-9-23-7-8-30-31(16-23)43-44-42-30)26-19-45(12-10-29(26)41-34)32(46)17-25-27(35(37,38)39)5-4-6-28(25)36/h4-8,13-16,22,40-41H,9-12,17-19H2,1-3H3,(H,42,43,44)/t22-/m1/s1
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0.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213663
PNG
(1-(3-((S)-1-(2-(6-(1H-tetrazol-5-yl)pyridin-3-yl)e...)
Show SMILES C[C@H](CNCCc1ccc(nc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C35H36F4N8O/c1-20-13-21(2)15-24(14-20)33-32(22(3)17-40-11-9-23-7-8-30(41-18-23)34-43-45-46-44-34)26-19-47(12-10-29(26)42-33)31(48)16-25-27(35(37,38)39)5-4-6-28(25)36/h4-8,13-15,18,22,40,42H,9-12,16-17,19H2,1-3H3,(H,43,44,45,46)/t22-/m1/s1
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0.600n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213652
PNG
((S)-1-(3-(1-(2-(3H-[1,2,3]triazolo[4,5-b]pyridin-6...)
Show SMILES C[C@H](CNCCc1cnc2nn[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C34H35F4N7O/c1-19-11-20(2)13-23(12-19)32-31(21(3)16-39-9-7-22-14-29-33(40-17-22)43-44-42-29)25-18-45(10-8-28(25)41-32)30(46)15-24-26(34(36,37)38)5-4-6-27(24)35/h4-6,11-14,17,21,39,41H,7-10,15-16,18H2,1-3H3,(H,40,42,43,44)/t21-/m1/s1
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0.600n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213657
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(6-fluoro-1H...)
Show SMILES C[C@H](CNCCc1cc2[nH]nnc2cc1F)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C35H35F5N6O/c1-19-11-20(2)13-23(12-19)34-33(21(3)17-41-9-7-22-14-30-31(16-28(22)37)44-45-43-30)25-18-46(10-8-29(25)42-34)32(47)15-24-26(35(38,39)40)5-4-6-27(24)36/h4-6,11-14,16,21,41-42H,7-10,15,17-18H2,1-3H3,(H,43,44,45)/t21-/m1/s1
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0.700n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213662
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(2-methyl-1H...)
Show SMILES C[C@H](CNCCc1ccc2nc(C)[nH]c2c1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C37H39F4N5O/c1-21-14-22(2)16-26(15-21)36-35(23(3)19-42-12-10-25-8-9-32-33(17-25)44-24(4)43-32)28-20-46(13-11-31(28)45-36)34(47)18-27-29(37(39,40)41)6-5-7-30(27)38/h5-9,14-17,23,42,45H,10-13,18-20H2,1-4H3,(H,43,44)/t23-/m1/s1
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1n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213653
PNG
((S)-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-yl)...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C1C(C)(C)C1(C)C
Show InChI InChI=1S/C33H44N4O/c1-21-16-22(2)18-25(17-21)29-28(23(3)19-35-14-10-24-8-12-34-13-9-24)26-20-37(15-11-27(26)36-29)31(38)30-32(4,5)33(30,6)7/h8-9,12-13,16-18,23,30,35-36H,10-11,14-15,19-20H2,1-7H3/t23-/m1/s1
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1.30n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213669
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1C(F)(F)F
Show InChI InChI=1S/C34H37F3N4O/c1-22-16-23(2)18-27(17-22)33-32(24(3)20-39-14-10-25-8-12-38-13-9-25)28-21-41(15-11-30(28)40-33)31(42)19-26-6-4-5-7-29(26)34(35,36)37/h4-9,12-13,16-18,24,39-40H,10-11,14-15,19-21H2,1-3H3/t24-/m1/s1
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1.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213650
PNG
(CHEMBL233341 | adamantan-1-yl-{2-(3,5-dimethyl-phe...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C12CC3CC(CC(C3)C1)C2 |TLB:40:31:38:34.35.36,THB:40:35:38:31.32.39,29:31:38:34.35.36,39:31:34:38.37.36,39:37:34:40.31.32|
Show InChI InChI=1S/C36H46N4O/c1-23-12-24(2)14-30(13-23)34-33(25(3)21-38-10-6-26-4-8-37-9-5-26)31-22-40(11-7-32(31)39-34)35(41)36-18-27-15-28(19-36)17-29(16-27)20-36/h4-5,8-9,12-14,25,27-29,38-39H,6-7,10-11,15-22H2,1-3H3/t25-,27?,28?,29?,36?/m1/s1
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1.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213666
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1F
Show InChI InChI=1S/C33H37FN4O/c1-22-16-23(2)18-27(17-22)33-32(24(3)20-36-14-10-25-8-12-35-13-9-25)28-21-38(15-11-30(28)37-33)31(39)19-26-6-4-5-7-29(26)34/h4-9,12-13,16-18,24,36-37H,10-11,14-15,19-21H2,1-3H3/t24-/m1/s1
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1.80n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213670
PNG
((S)-7-(2-(2-(2-(3,5-dimethylphenyl)-5-(2-(2-fluoro...)
Show SMILES CCn1c(=O)[nH]c2cc(CCNC[C@@H](C)c3c4CN(CCc4[nH]c3-c3cc(C)cc(C)c3)C(=O)Cc3c(F)cccc3C(F)(F)F)ccc2c1=O
Show InChI InChI=1S/C39H41F4N5O3/c1-5-48-37(50)27-10-9-25(18-33(27)46-38(48)51)11-13-44-20-24(4)35-29-21-47(34(49)19-28-30(39(41,42)43)7-6-8-31(28)40)14-12-32(29)45-36(35)26-16-22(2)15-23(3)17-26/h6-10,15-18,24,44-45H,5,11-14,19-21H2,1-4H3,(H,46,51)/t24-/m1/s1
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1.80n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213656
PNG
((S)-4-(2-(2-(2-(3,5-dimethylphenyl)-5-(2-(2-fluoro...)
Show SMILES C[C@H](CNCCc1ccc(cc1)C(O)=O)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C36H37F4N3O3/c1-21-15-22(2)17-26(16-21)34-33(23(3)19-41-13-11-24-7-9-25(10-8-24)35(45)46)28-20-43(14-12-31(28)42-34)32(44)18-27-29(36(38,39)40)5-4-6-30(27)37/h4-10,15-17,23,41-42H,11-14,18-20H2,1-3H3,(H,45,46)/t23-/m1/s1
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2n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213667
PNG
((S)-2-(2-chlorophenyl)-1-(2-(3,5-dimethylphenyl)-3...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1Cl
Show InChI InChI=1S/C33H37ClN4O/c1-22-16-23(2)18-27(17-22)33-32(24(3)20-36-14-10-25-8-12-35-13-9-25)28-21-38(15-11-30(28)37-33)31(39)19-26-6-4-5-7-29(26)34/h4-9,12-13,16-18,24,36-37H,10-11,14-15,19-21H2,1-3H3/t24-/m1/s1
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2.60n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213673
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1
Show InChI InChI=1S/C33H38N4O/c1-23-17-24(2)19-28(18-23)33-32(25(3)21-35-15-11-26-9-13-34-14-10-26)29-22-37(16-12-30(29)36-33)31(38)20-27-7-5-4-6-8-27/h4-10,13-14,17-19,25,35-36H,11-12,15-16,20-22H2,1-3H3/t25-/m1/s1
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4.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213655
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(tetrahydro-...)
Show SMILES C[C@H](CNCCC1CCOCC1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1ccccc1C(F)(F)F
Show InChI InChI=1S/C34H42F3N3O2/c1-22-16-23(2)18-27(17-22)33-32(24(3)20-38-12-8-25-10-14-42-15-11-25)28-21-40(13-9-30(28)39-33)31(41)19-26-6-4-5-7-29(26)34(35,36)37/h4-7,16-18,24-25,38-39H,8-15,19-21H2,1-3H3/t24-/m1/s1
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4.70n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215208
PNG
(6-(2,4-dimethylbenzyl)-1-(2,6-difluorobenzyl)-3-(2...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C33H37F2N5O2/c1-23-10-11-25(24(2)19-23)20-38-16-13-31-28(21-38)32(41)39(18-17-37(3)15-12-26-7-4-5-14-36-26)33(42)40(31)22-27-29(34)8-6-9-30(27)35/h4-11,14,19H,12-13,15-18,20-22H2,1-3H3
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5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215203
PNG
(1-(2,6-difluorobenzyl)-6-(4-chloro-2-methylbenzyl)...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C32H34ClF2N5O2/c1-22-18-24(33)10-9-23(22)19-38-15-12-30-27(20-38)31(41)39(17-16-37(2)14-11-25-6-3-4-13-36-25)32(42)40(30)21-26-28(34)7-5-8-29(26)35/h3-10,13,18H,11-12,14-17,19-21H2,1-2H3
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5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213661
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES COc1ccccc1CC(=O)N1CCc2[nH]c(c([C@H](C)CNCCc3ccncc3)c2C1)-c1cc(C)cc(C)c1
Show InChI InChI=1S/C34H40N4O2/c1-23-17-24(2)19-28(18-23)34-33(25(3)21-36-15-11-26-9-13-35-14-10-26)29-22-38(16-12-30(29)37-34)32(39)20-27-7-5-6-8-31(27)40-4/h5-10,13-14,17-19,25,36-37H,11-12,15-16,20-22H2,1-4H3/t25-/m1/s1
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5.60n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213660
PNG
((S)-1-(3-(1-(2-(4-(1H-tetrazol-5-yl)phenoxy)ethyla...)
Show SMILES C[C@H](CNCCOc1ccc(cc1)-c1nnn[nH]1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C36H37F4N7O2/c1-21-15-22(2)17-25(16-21)34-33(23(3)19-41-12-14-49-26-9-7-24(8-10-26)35-43-45-46-44-35)28-20-47(13-11-31(28)42-34)32(48)18-27-29(36(38,39)40)5-4-6-30(27)37/h4-10,15-17,23,41-42H,11-14,18-20H2,1-3H3,(H,43,44,45,46)/t23-/m1/s1
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6.20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215223
PNG
(1-(2,6-difluorobenzyl)-6-(4-(methylthio)benzyl)-3-...)
Show SMILES CSc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Show InChI InChI=1S/C32H35F2N5O2S/c1-36(16-13-24-6-3-4-15-35-24)18-19-38-31(40)27-21-37(20-23-9-11-25(42-2)12-10-23)17-14-30(27)39(32(38)41)22-26-28(33)7-5-8-29(26)34/h3-12,15H,13-14,16-22H2,1-2H3
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10n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215168
PNG
(1-(2-fluoro-6-(trifluoromethyl)benzyl)-3-(2-(methy...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2c(F)cccc2C(F)(F)F)c1=O
Show InChI InChI=1S/C35H35F4N5O2S/c1-23-25-9-3-4-12-31(25)47-32(23)22-42-17-14-30-27(20-42)33(45)43(19-18-41(2)16-13-24-8-5-6-15-40-24)34(46)44(30)21-26-28(35(37,38)39)10-7-11-29(26)36/h3-12,15H,13-14,16-22H2,1-2H3
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10n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215184
PNG
((R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-((...)
Show SMILES Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2CCc2ccccn2)c1=O
Show InChI InChI=1S/C33H34ClF2N5O2/c34-24-11-9-23(10-12-24)19-38-17-14-31-28(21-38)32(42)41(33(43)40(31)22-27-29(35)7-3-8-30(27)36)20-26-6-4-16-39(26)18-13-25-5-1-2-15-37-25/h1-3,5,7-12,15,26H,4,6,13-14,16-22H2/t26-/m1/s1
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10n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215209
PNG
(1-(2,6-difluorobenzyl)-3-(2-(methyl(2-(pyridin-2-y...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C34H35F2N5O2S/c1-23-25-9-3-4-12-31(25)44-32(23)22-39-17-14-30-27(20-39)33(42)40(19-18-38(2)16-13-24-8-5-6-15-37-24)34(43)41(30)21-26-28(35)10-7-11-29(26)36/h3-12,15H,13-14,16-22H2,1-2H3
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15n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215165
PNG
(1-(2,6-difluorobenzyl)-6-(4-(ethylthio)benzyl)-3-(...)
Show SMILES CCSc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Show InChI InChI=1S/C33H37F2N5O2S/c1-3-43-26-12-10-24(11-13-26)21-38-18-15-31-28(22-38)32(41)39(20-19-37(2)17-14-25-7-4-5-16-36-25)33(42)40(31)23-27-29(34)8-6-9-30(27)35/h4-13,16H,3,14-15,17-23H2,1-2H3
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15n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215214
PNG
(1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-(2-(me...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C31H32ClF2N5O2/c1-36(15-12-24-5-2-3-14-35-24)17-18-38-30(40)26-20-37(19-22-8-10-23(32)11-9-22)16-13-29(26)39(31(38)41)21-25-27(33)6-4-7-28(25)34/h2-11,14H,12-13,15-21H2,1H3
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17n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213674
PNG
((S)-cyclopentyl(2-(3,5-dimethylphenyl)-3-(1-(2-(py...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)C1CCCC1
Show InChI InChI=1S/C31H40N4O/c1-21-16-22(2)18-26(17-21)30-29(23(3)19-33-14-10-24-8-12-32-13-9-24)27-20-35(15-11-28(27)34-30)31(36)25-6-4-5-7-25/h8-9,12-13,16-18,23,25,33-34H,4-7,10-11,14-15,19-20H2,1-3H3/t23-/m1/s1
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18n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215218
PNG
((R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-((...)
Show SMILES Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCN2Cc2ccccn2)c1=O
Show InChI InChI=1S/C32H32ClF2N5O2/c33-23-11-9-22(10-12-23)17-37-16-13-30-27(20-37)31(41)40(32(42)39(30)21-26-28(34)7-3-8-29(26)35)19-25-6-4-15-38(25)18-24-5-1-2-14-36-24/h1-3,5,7-12,14,25H,4,6,13,15-21H2/t25-/m1/s1
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20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215204
PNG
(1-(2,6-difluorobenzyl)-6-(4-ethylbenzyl)-3-(2-(met...)
Show SMILES CCc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Show InChI InChI=1S/C33H37F2N5O2/c1-3-24-10-12-25(13-11-24)21-38-18-15-31-28(22-38)32(41)39(20-19-37(2)17-14-26-7-4-5-16-36-26)33(42)40(31)23-27-29(34)8-6-9-30(27)35/h4-13,16H,3,14-15,17-23H2,1-2H3
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20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215193
PNG
(6-(2,4-dimethylbenzyl)-1-(2,6-difluorobenzyl)-3-((...)
Show SMILES Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCCN2Cc2ccccn2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
Show InChI InChI=1S/C35H39F2N5O2/c1-24-12-13-26(25(2)18-24)19-39-17-14-33-30(22-39)34(43)42(35(44)41(33)23-29-31(36)10-7-11-32(29)37)21-28-9-4-6-16-40(28)20-27-8-3-5-15-38-27/h3,5,7-8,10-13,15,18,28H,4,6,9,14,16-17,19-23H2,1-2H3
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25n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215211
PNG
((R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-((...)
Show SMILES Fc1cccc(F)c1Cn1c2CCN(Cc3ccc(Cl)cc3)Cc2c(=O)n(C[C@H]2CCCCN2CCc2ccccn2)c1=O
Show InChI InChI=1S/C34H36ClF2N5O2/c35-25-12-10-24(11-13-25)20-39-18-15-32-29(22-39)33(43)42(34(44)41(32)23-28-30(36)8-5-9-31(28)37)21-27-7-2-4-17-40(27)19-14-26-6-1-3-16-38-26/h1,3,5-6,8-13,16,27H,2,4,7,14-15,17-23H2/t27-/m1/s1
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30n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215179
PNG
(1-(2,6-difluorobenzyl)-6-(4-(trifluoromethyl)benzy...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)C(F)(F)F)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C32H32F5N5O2/c1-39(15-12-24-5-2-3-14-38-24)17-18-41-30(43)26-20-40(19-22-8-10-23(11-9-22)32(35,36)37)16-13-29(26)42(31(41)44)21-25-27(33)6-4-7-28(25)34/h2-11,14H,12-13,15-21H2,1H3
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30n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215190
PNG
(1-(2,6-difluoro-benzyl)-6-(4-methyl-benzyl)-3-{2-[...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(C)cc3)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C32H35F2N5O2/c1-23-9-11-24(12-10-23)20-37-17-14-30-27(21-37)31(40)38(19-18-36(2)16-13-25-6-3-4-15-35-25)32(41)39(30)22-26-28(33)7-5-8-29(26)34/h3-12,15H,13-14,16-22H2,1-2H3
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35n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215221
PNG
((R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-(2...)
Show SMILES CN[C@@H](Cn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O)c1ccccc1
Show InChI InChI=1S/C30H29ClF2N4O2/c1-34-27(21-6-3-2-4-7-21)19-37-29(38)24-17-35(16-20-10-12-22(31)13-11-20)15-14-28(24)36(30(37)39)18-23-25(32)8-5-9-26(23)33/h2-13,27,34H,14-19H2,1H3/t27-/m0/s1
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45n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215175
PNG
((R)-1-(2,6-difluorobenzyl)-6-(4-chlorobenzyl)-3-(2...)
Show SMILES CN(C)[C@@H](Cn1c(=O)c2CN(Cc3ccc(Cl)cc3)CCc2n(Cc2c(F)cccc2F)c1=O)c1ccccc1
Show InChI InChI=1S/C31H31ClF2N4O2/c1-35(2)29(22-7-4-3-5-8-22)20-38-30(39)25-18-36(17-21-11-13-23(32)14-12-21)16-15-28(25)37(31(38)40)19-24-26(33)9-6-10-27(24)34/h3-14,29H,15-20H2,1-2H3/t29-/m0/s1
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70n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215177
PNG
(1-(2-fluorobenzyl)-3-(2-(methyl(2-(pyridin-2-yl)et...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2ccccc2F)c1=O
Show InChI InChI=1S/C34H36FN5O2S/c1-24-27-11-4-6-13-31(27)43-32(24)23-38-18-15-30-28(22-38)33(41)39(20-19-37(2)17-14-26-10-7-8-16-36-26)34(42)40(30)21-25-9-3-5-12-29(25)35/h3-13,16H,14-15,17-23H2,1-2H3
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80n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215217
PNG
(1-(2,6-difluoro-benzyl)-6-(2-methyl-benzyl)-3-{2-[...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccccc3C)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C32H35F2N5O2/c1-23-8-3-4-9-24(23)20-37-17-14-30-27(21-37)31(40)38(19-18-36(2)16-13-25-10-5-6-15-35-25)32(41)39(30)22-26-28(33)11-7-12-29(26)34/h3-12,15H,13-14,16-22H2,1-2H3
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85n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215173
PNG
(1-(2,6-difluorobenzyl)-6-(4-methoxybenzyl)-3-(2-(m...)
Show SMILES COc1ccc(CN2CCc3c(C2)c(=O)n(CCN(C)CCc2ccccn2)c(=O)n3Cc2c(F)cccc2F)cc1
Show InChI InChI=1S/C32H35F2N5O3/c1-36(16-13-24-6-3-4-15-35-24)18-19-38-31(40)27-21-37(20-23-9-11-25(42-2)12-10-23)17-14-30(27)39(32(38)41)22-26-28(33)7-5-8-29(26)34/h3-12,15H,13-14,16-22H2,1-2H3
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100n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213654
PNG
((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...)
Show SMILES C[C@H](CNCCc1ccncc1)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(C)=O
Show InChI InChI=1S/C27H34N4O/c1-18-13-19(2)15-23(14-18)27-26(24-17-31(21(4)32)12-8-25(24)30-27)20(3)16-29-11-7-22-5-9-28-10-6-22/h5-6,9-10,13-15,20,29-30H,7-8,11-12,16-17H2,1-4H3/t20-/m1/s1
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120n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215191
PNG
(6-(2,4-dimethylbenzyl)-1-(2,6-difluorobenzyl)-3-((...)
Show SMILES Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(Cc4ccccc4)C2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
Show InChI InChI=1S/C36H40F2N4O2/c1-25-13-14-29(26(2)18-25)22-40-17-15-34-31(23-40)35(43)42(36(44)41(34)24-30-32(37)11-6-12-33(30)38)21-28-10-7-16-39(20-28)19-27-8-4-3-5-9-27/h3-6,8-9,11-14,18,28H,7,10,15-17,19-24H2,1-2H3
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160n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215188
PNG
(6-(2,4-dimethylbenzyl)-1-(2,6-difluorobenzyl)-3-(2...)
Show SMILES CN(CCn1c(=O)c2CN(Cc3ccc(C)cc3C)CCc2n(Cc2c(F)cccc2F)c1=O)Cc1ccccn1
Show InChI InChI=1S/C32H35F2N5O2/c1-22-10-11-24(23(2)17-22)18-37-14-12-30-27(20-37)31(40)38(16-15-36(3)19-25-7-4-5-13-35-25)32(41)39(30)21-26-28(33)8-6-9-29(26)34/h4-11,13,17H,12,14-16,18-21H2,1-3H3
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180n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215222
PNG
(1-(2,6-difluorobenzyl)-6-(3,4-dichlorobenzyl)-3-(2...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(Cl)c(Cl)c3)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C31H31Cl2F2N5O2/c1-37(13-10-22-5-2-3-12-36-22)15-16-39-30(41)24-19-38(18-21-8-9-25(32)26(33)17-21)14-11-29(24)40(31(39)42)20-23-27(34)6-4-7-28(23)35/h2-9,12,17H,10-11,13-16,18-20H2,1H3
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255n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215216
PNG
(1-(2,6-difluorobenzyl)-6-(4-tert-butylbenzyl)-3-(2...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3ccc(cc3)C(C)(C)C)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C35H41F2N5O2/c1-35(2,3)26-13-11-25(12-14-26)22-40-19-16-32-29(23-40)33(43)41(21-20-39(4)18-15-27-8-5-6-17-38-27)34(44)42(32)24-28-30(36)9-7-10-31(28)37/h5-14,17H,15-16,18-24H2,1-4H3
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300n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215170
PNG
(1-benzyl-3-(2-(methyl(2-(pyridin-2-yl)ethyl)amino)...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(Cc2ccccc2)c1=O
Show InChI InChI=1S/C34H37N5O2S/c1-25-28-13-6-7-14-31(28)42-32(25)24-37-19-16-30-29(23-37)33(40)38(34(41)39(30)22-26-10-4-3-5-11-26)21-20-36(2)18-15-27-12-8-9-17-35-27/h3-14,17H,15-16,18-24H2,1-2H3
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305n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215207
PNG
(1-(cyclohexylmethyl)-3-(2-(methyl(2-(pyridin-2-yl)...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(Cc3sc4ccccc4c3C)CCc2n(CC2CCCCC2)c1=O
Show InChI InChI=1S/C34H43N5O2S/c1-25-28-13-6-7-14-31(28)42-32(25)24-37-19-16-30-29(23-37)33(40)38(34(41)39(30)22-26-10-4-3-5-11-26)21-20-36(2)18-15-27-12-8-9-17-35-27/h6-9,12-14,17,26H,3-5,10-11,15-16,18-24H2,1-2H3
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380n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50213672
PNG
((S)-1-(3-(1-aminopropan-2-yl)-2-(3,5-dimethylpheny...)
Show SMILES C[C@H](CN)c1c2CN(CCc2[nH]c1-c1cc(C)cc(C)c1)C(=O)Cc1c(F)cccc1C(F)(F)F
Show InChI InChI=1S/C27H29F4N3O/c1-15-9-16(2)11-18(10-15)26-25(17(3)13-32)20-14-34(8-7-23(20)33-26)24(35)12-19-21(27(29,30)31)5-4-6-22(19)28/h4-6,9-11,17,33H,7-8,12-14,32H2,1-3H3/t17-/m1/s1
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470n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR


Bioorg Med Chem Lett 17: 3845-50 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.009
BindingDB Entry DOI: 10.7270/Q2JD4WHQ
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215174
PNG
(6-(2,4-dimethylbenzyl)-1-(2,6-difluorobenzyl)-3-((...)
Show SMILES Cc1ccc(CN2CCc3c(C2)c(=O)n(CC2CCCN(Cc4ccccn4)C2)c(=O)n3Cc2c(F)cccc2F)c(C)c1 |w:16.16|
Show InChI InChI=1S/C35H39F2N5O2/c1-24-11-12-27(25(2)17-24)20-40-16-13-33-30(22-40)34(43)42(35(44)41(33)23-29-31(36)9-5-10-32(29)37)19-26-7-6-15-39(18-26)21-28-8-3-4-14-38-28/h3-5,8-12,14,17,26H,6-7,13,15-16,18-23H2,1-2H3
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490n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50215180
PNG
(6-(2-(1H-indol-3-yl)ethyl)-1-(2,6-difluorobenzyl)-...)
Show SMILES CN(CCc1ccccn1)CCn1c(=O)c2CN(CCc3c[nH]c4ccccc34)CCc2n(Cc2c(F)cccc2F)c1=O
Show InChI InChI=1S/C34H36F2N6O2/c1-39(16-13-25-7-4-5-15-37-25)19-20-41-33(43)28-22-40(17-12-24-21-38-31-11-3-2-8-26(24)31)18-14-32(28)42(34(41)44)23-27-29(35)9-6-10-30(27)36/h2-11,15,21,38H,12-14,16-20,22-23H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
515n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I-His5,D-Tyr6]GnRH from human cloned GnRH receptor transfected in COS7 cells


Bioorg Med Chem 15: 5590-603 (2007)


Article DOI: 10.1016/j.bmc.2007.05.029
BindingDB Entry DOI: 10.7270/Q2VH5NJG
More data for this
Ligand-Target Pair
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