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Compile Data Set for Download or QSAR

Found 26 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50014570   
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


(Homo sapiens (Human))
BDBM50144640
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2-chloro-6-fluor...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;1.89,-1.99,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.79,)|
Show InChI InChI=1S/C26H22ClF2N3O2/c1-16-24(18-10-5-6-12-21(18)28)25(33)32(15-23(30)17-8-3-2-4-9-17)26(34)31(16)14-19-20(27)11-7-13-22(19)29/h2-13,23H,14-15,30H2,1H3/t23-/m0/s1
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0.700n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144629
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1C(F)(F)F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.81,;1.49,-6.14,;3.04,-6.14,;3.8,-4.81,;5.35,-4.79,;6.75,-4.79,;6.38,-6.03,;6.37,-3.53,)|
Show InChI InChI=1S/C27H23F4N3O2/c1-17-24(20-12-6-8-14-22(20)28)25(35)34(16-23(32)18-9-3-2-4-10-18)26(36)33(17)15-19-11-5-7-13-21(19)27(29,30)31/h2-14,23H,15-16,32H2,1H3/t23-/m0/s1
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4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144631
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2,6-difluoro-ben...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1c(F)cccc1F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;1.89,-1.99,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.79,)|
Show InChI InChI=1S/C26H22F3N3O2/c1-16-24(18-10-5-6-11-20(18)27)25(33)32(15-23(30)17-8-3-2-4-9-17)26(34)31(16)14-19-21(28)12-7-13-22(19)29/h2-13,23H,14-15,30H2,1H3/t23-/m0/s1
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6n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144649
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2-fluoro-benzyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1F |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.34,-4.81,)|
Show InChI InChI=1S/C26H23F2N3O2/c1-17-24(20-12-6-8-14-22(20)28)25(32)31(16-23(29)18-9-3-2-4-10-18)26(33)30(17)15-19-11-5-7-13-21(19)27/h2-14,23H,15-16,29H2,1H3/t23-/m0/s1
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20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144648
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2-chloro-benzyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;5.35,-4.82,)|
Show InChI InChI=1S/C26H23ClFN3O2/c1-17-24(20-12-6-8-14-22(20)28)25(32)31(16-23(29)18-9-3-2-4-10-18)26(33)30(17)15-19-11-5-7-13-21(19)27/h2-14,23H,15-16,29H2,1H3/t23-/m0/s1
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27n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144632
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2-chloro-4-fluor...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1Cl |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.73,-7.48,;.72,-4.82,;1.49,-3.49,;1.89,-1.99,)|
Show InChI InChI=1S/C26H22ClF2N3O2/c1-16-24(20-9-5-6-10-22(20)29)25(33)32(15-23(30)17-7-3-2-4-8-17)26(34)31(16)14-18-11-12-19(28)13-21(18)27/h2-13,23H,14-15,30H2,1H3/t23-/m0/s1
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33n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144638
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:23.25,(5.34,-4.79,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.72,-4.82,;1.49,-3.49,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C27H26FN3O2/c1-18-10-6-7-13-21(18)16-30-19(2)25(22-14-8-9-15-23(22)28)26(32)31(27(30)33)17-24(29)20-11-4-3-5-12-20/h3-15,24H,16-17,29H2,1-2H3/t24-/m0/s1
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35n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144639
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-benzyl-5-(2-fluor...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,)|
Show InChI InChI=1S/C26H24FN3O2/c1-18-24(21-14-8-9-15-22(21)27)25(31)30(17-23(28)20-12-6-3-7-13-20)26(32)29(18)16-19-10-4-2-5-11-19/h2-15,23H,16-17,28H2,1H3/t23-/m0/s1
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57n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144628
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(3-fluoro-benzyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccc(F)c1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.81,-7.48,;3.8,-4.81,)|
Show InChI InChI=1S/C26H23F2N3O2/c1-17-24(21-12-5-6-13-22(21)28)25(32)31(16-23(29)19-9-3-2-4-10-19)26(33)30(17)15-18-8-7-11-20(27)14-18/h2-14,23H,15-16,29H2,1H3/t23-/m0/s1
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67n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144651
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(4-fluoro-benzyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccc(F)cc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.73,-7.48,;.72,-4.82,;1.49,-3.49,)|
Show InChI InChI=1S/C26H23F2N3O2/c1-17-24(21-9-5-6-10-22(21)28)25(32)31(16-23(29)19-7-3-2-4-8-19)26(33)30(17)15-18-11-13-20(27)14-12-18/h2-14,23H,15-16,29H2,1H3/t23-/m0/s1
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75n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144647
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1ccccn1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.81,;1.49,-6.14,;3.04,-6.14,;3.8,-4.81,)|
Show InChI InChI=1S/C25H23FN4O2/c1-17-23(20-12-5-6-13-21(20)26)24(31)30(16-22(27)18-9-3-2-4-10-18)25(32)29(17)15-19-11-7-8-14-28-19/h2-14,22H,15-16,27H2,1H3/t22-/m0/s1
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77n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144645
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES CC(c1ccccc1)n1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:23.25,(5.34,-2.15,;3.8,-2.15,;3.03,-3.49,;1.49,-3.49,;.72,-4.82,;1.49,-6.15,;3.04,-6.15,;3.8,-4.81,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C27H26FN3O2/c1-18(20-11-5-3-6-12-20)31-19(2)25(22-15-9-10-16-23(22)28)26(32)30(27(31)33)17-24(29)21-13-7-4-8-14-21/h3-16,18,24H,17,29H2,1-2H3/t18?,24-/m0/s1
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140n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144630
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-cyclohexylmethyl-...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CCCCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;1.49,-3.48,;.72,-4.79,;1.49,-6.14,;3.03,-6.14,;3.81,-4.81,)|
Show InChI InChI=1S/C26H30FN3O2/c1-18-24(21-14-8-9-15-22(21)27)25(31)30(17-23(28)20-12-6-3-7-13-20)26(32)29(18)16-19-10-4-2-5-11-19/h3,6-9,12-15,19,23H,2,4-5,10-11,16-17,28H2,1H3/t23-/m0/s1
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200n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144635
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES CCCCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:20.21,(3.81,-7.48,;3.03,-6.15,;3.8,-4.82,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C24H28FN3O2/c1-3-4-10-15-27-17(2)22(19-13-8-9-14-20(19)25)23(29)28(24(27)30)16-21(26)18-11-6-5-7-12-18/h5-9,11-14,21H,3-4,10,15-16,26H2,1-2H3/t21-/m0/s1
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230n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144652
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES COc1ccccc1Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:24.26,(6.1,-3.46,;5.33,-4.81,;3.8,-4.81,;3.04,-6.15,;1.49,-6.15,;.72,-4.82,;1.49,-3.49,;3.03,-3.49,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C27H26FN3O3/c1-18-25(21-13-7-8-14-22(21)28)26(32)31(17-23(29)19-10-4-3-5-11-19)27(33)30(18)16-20-12-6-9-15-24(20)34-2/h3-15,23H,16-17,29H2,1-2H3/t23-/m0/s1
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230n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144643
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-cyclohexyl-5-(2-f...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1C1CCCCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.02,-3.49,;3.79,-4.82,;5.33,-4.82,;6.1,-3.49,;5.33,-2.15,)|
Show InChI InChI=1S/C25H28FN3O2/c1-17-23(20-14-8-9-15-21(20)26)24(30)28(16-22(27)18-10-4-2-5-11-18)25(31)29(17)19-12-6-3-7-13-19/h2,4-5,8-11,14-15,19,22H,3,6-7,12-13,16,27H2,1H3/t22-/m0/s1
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260n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144634
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1ccc(Cn2c(C)c(-c3ccccc3F)c(=O)n(C[C@H](N)c3ccccc3)c2=O)o1 |wD:21.22,(2.68,-7.44,;2.52,-5.91,;1.19,-5.14,;1.5,-3.64,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.67,-4.88,)|
Show InChI InChI=1S/C25H24FN3O3/c1-16-12-13-19(32-16)14-28-17(2)23(20-10-6-7-11-21(20)26)24(30)29(25(28)31)15-22(27)18-8-4-3-5-9-18/h3-13,22H,14-15,27H2,1-2H3/t22-/m0/s1
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430n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144633
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES CC(C)Cn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(1.49,-3.48,;3.03,-3.48,;3.8,-4.81,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C23H26FN3O2/c1-15(2)13-26-16(3)21(18-11-7-8-12-19(18)24)22(28)27(23(26)29)14-20(25)17-9-5-4-6-10-17/h4-12,15,20H,13-14,25H2,1-3H3/t20-/m0/s1
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500n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144644
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1Cc1cccnc1 |wD:14.15,(5.35,.51,;3.81,.51,;3.04,1.85,;3.81,3.18,;5.35,3.18,;6.12,4.51,;5.35,5.86,;3.79,5.84,;3.04,4.51,;1.5,4.5,;1.5,1.85,;.71,3.18,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.81,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.16,;3.04,-.82,;3.81,-2.15,;3.04,-3.49,;1.5,-3.49,;.72,-4.82,;1.5,-6.15,;3.04,-6.15,;3.81,-4.81,)|
Show InChI InChI=1S/C25H23FN4O2/c1-17-23(20-11-5-6-12-21(20)26)24(31)30(16-22(27)19-9-3-2-4-10-19)25(32)29(17)15-18-8-7-13-28-14-18/h2-14,22H,15-16,27H2,1H3/t22-/m0/s1
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700n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144641
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccc1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.82,;3.03,-6.15,;3.8,-7.48,;5.34,-7.48,;6.11,-6.14,;5.34,-4.81,)|
Show InChI InChI=1S/C27H26FN3O2/c1-19-25(22-14-8-9-15-23(22)28)26(32)31(18-24(29)21-12-6-3-7-13-21)27(33)30(19)17-16-20-10-4-2-5-11-20/h2-15,24H,16-18,29H2,1H3/t24-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144642
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-cyclopropylmethyl...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CC1CC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;1.71,-4.26,;3.04,-5.03,)|
Show InChI InChI=1S/C23H24FN3O2/c1-15-21(18-9-5-6-10-19(18)24)22(28)27(23(29)26(15)13-16-11-12-16)14-20(25)17-7-3-2-4-8-17/h2-10,16,20H,11-14,25H2,1H3/t20-/m0/s1
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1.10E+3n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144653
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES COCCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:19.20,(3.03,-6.14,;3.8,-4.81,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C22H24FN3O3/c1-15-20(17-10-6-7-11-18(17)23)21(27)26(22(28)25(15)12-13-29-2)14-19(24)16-8-4-3-5-9-16/h3-11,19H,12-14,24H2,1-2H3/t19-/m0/s1
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PubMed
1.70E+3n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144650
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCN1CCNCC1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;3.8,-4.81,;3.03,-6.14,;3.79,-7.47,;5.33,-7.47,;6.1,-6.14,;5.34,-4.79,)|
Show InChI InChI=1S/C25H30FN5O2/c1-18-23(20-9-5-6-10-21(20)26)24(32)31(17-22(27)19-7-3-2-4-8-19)25(33)30(18)16-15-29-13-11-28-12-14-29/h2-10,22,28H,11-17,27H2,1H3/t22-/m0/s1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144637
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCO |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.48,;3.8,-4.81,)|
Show InChI InChI=1S/C21H22FN3O3/c1-14-19(16-9-5-6-10-17(16)22)20(27)25(21(28)24(14)11-12-26)13-18(23)15-7-3-2-4-8-15/h2-10,18,26H,11-13,23H2,1H3/t18-/m0/s1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144646
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-5-(2-fluoro-phenyl)...)
Show SMILES Cc1c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c(=O)n1CCc1ccccn1 |wD:14.15,(5.34,.51,;3.8,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-3.47,2.05,;-4.81,2.82,;-6.14,2.05,;-6.14,.51,;-4.81,-.26,;1.5,-.82,;.73,-2.15,;3.03,-.82,;3.8,-2.15,;3.03,-3.49,;3.8,-4.82,;3.03,-6.15,;3.8,-7.48,;5.34,-7.48,;6.11,-6.14,;5.34,-4.81,)|
Show InChI InChI=1S/C26H25FN4O2/c1-18-24(21-12-5-6-13-22(21)27)25(32)31(17-23(28)19-9-3-2-4-10-19)26(33)30(18)16-14-20-11-7-8-15-29-20/h2-13,15,23H,14,16-17,28H2,1H3/t23-/m0/s1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50144636
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2-dimethylamino-...)
Show SMILES CN(C)CCn1c(C)c(-c2ccccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O |wD:20.21,(5.35,-4.81,;3.8,-4.81,;3.04,-6.14,;3.03,-3.48,;3.8,-2.15,;3.03,-.82,;3.8,.51,;5.34,.51,;3.03,1.84,;3.8,3.17,;5.34,3.17,;6.11,4.5,;5.34,5.85,;3.79,5.83,;3.03,4.5,;1.49,4.5,;1.49,1.84,;.71,3.17,;.73,.51,;-.81,.51,;-2.14,-.26,;-2.14,-1.8,;-3.47,.51,;-4.81,-.26,;-6.14,.51,;-6.14,2.05,;-4.81,2.82,;-3.47,2.05,;1.5,-.82,;.73,-2.15,)|
Show InChI InChI=1S/C23H27FN4O2/c1-16-21(18-11-7-8-12-19(18)24)22(29)28(23(30)27(16)14-13-26(2)3)15-20(25)17-9-5-4-6-10-17/h4-12,20H,13-15,25H2,1-3H3/t20-/m0/s1
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity towards human gonadotropin-releasing hormone receptor expressed in HEK293 cells using des-Gly10-[125I]Tyr,5 DLeu,6 NMeLeu,7 Pro9-NEt...


Bioorg Med Chem Lett 14: 2269-74 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.004
BindingDB Entry DOI: 10.7270/Q2736QCQ
More data for this
Ligand-Target Pair