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Compile Data Set for Download or QSAR

Found 128 hits Enz. Inhib. hit(s) with all data for entry = 50011550   
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))
BDBM50548475
PNG
(CHEMBL4747248)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccc(F)c3)cc21)S(=O)(=O)c1ccc(F)cc1
PDB

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UniProtKB/SwissProt

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UniChem
Article
PubMed
n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548486
PNG
(CHEMBL4741994)
Show SMILES CC(=O)N1CCC2(CC1)C(CC=C)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548470
PNG
(CHEMBL4749974)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=N)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 13n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548470
PNG
(CHEMBL4749974)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=N)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
PDB

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n/an/a 13n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
PDB

KEGG

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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
PDB

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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50041550
PNG
(CHEMBL3358413)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(Cl)cc1C(F)(F)F
Show InChI InChI=1S/C29H26ClF4N3O5S2/c30-19-14-22(29(32,33)34)24(35-15-19)16-36-27(38)18-3-8-25-23(13-18)28(9-11-43(39,40)12-10-28)26(17-1-2-17)37(25)44(41,42)21-6-4-20(31)5-7-21/h3-8,13-15,17,26H,1-2,9-12,16H2,(H,36,38)
PDB

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Article
PubMed
n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548475
PNG
(CHEMBL4747248)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccc(F)c3)cc21)S(=O)(=O)c1ccc(F)cc1
PDB

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UniProtKB/SwissProt

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PC sid
UniChem
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n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548469
PNG
(CHEMBL4762368)
Show SMILES [O-][S+]1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(35.81,-1.68,;35.41,-3.17,;36.5,-4.27,;36.11,-5.75,;34.63,-6.15,;33.53,-5.08,;33.93,-3.59,;35.55,-7.39,;37.09,-7.37,;38.44,-8.13,;38.42,-6.58,;34.66,-8.66,;33.18,-8.2,;31.84,-8.97,;30.51,-8.21,;30.51,-6.67,;29.17,-5.91,;27.84,-6.68,;27.85,-8.22,;26.5,-5.92,;26.5,-4.38,;25.17,-3.62,;23.83,-4.39,;23.85,-5.94,;25.18,-6.7,;31.83,-5.89,;33.16,-6.65,;35.15,-10.11,;36.63,-9.71,;36.24,-11.2,;34.14,-11.27,;32.63,-10.97,;31.61,-12.13,;32.11,-13.59,;31.1,-14.76,;33.63,-13.89,;34.64,-12.72,)|
PDB

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n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548468
PNG
(CHEMBL4747322)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
PDB

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n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548463
PNG
(CHEMBL4781434)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
PDB

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UniProtKB/SwissProt

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UniChem
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PubMed
n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548488
PNG
(CHEMBL4780737)
Show SMILES CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548493
PNG
(BAY-784)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1[C@@H](C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
PDB

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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548488
PNG
(CHEMBL4780737)
Show SMILES CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548486
PNG
(CHEMBL4741994)
Show SMILES CC(=O)N1CCC2(CC1)C(CC=C)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548493
PNG
(BAY-784)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1[C@@H](C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
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PC sid
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n/an/a 24n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins foll...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548483
PNG
(CHEMBL4761024)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 24n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548470
PNG
(CHEMBL4749974)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=N)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
PDB

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n/an/a 26n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548470
PNG
(CHEMBL4749974)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=N)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
PDB

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UniChem
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n/an/a 26n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548467
PNG
(CHEMBL4787856)
Show SMILES OC1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(36.16,-32.54,;35.77,-34.03,;36.86,-35.12,;36.47,-36.6,;34.98,-37.01,;33.89,-35.93,;34.29,-34.44,;35.91,-38.25,;37.45,-38.23,;38.8,-38.98,;38.77,-37.44,;35.02,-39.51,;33.54,-39.05,;32.2,-39.83,;30.86,-39.06,;30.86,-37.52,;29.53,-36.76,;28.2,-37.54,;28.2,-39.08,;26.86,-36.77,;26.86,-35.24,;25.52,-34.47,;24.19,-35.25,;24.2,-36.8,;25.54,-37.55,;32.18,-36.75,;33.52,-37.5,;35.51,-40.97,;36.99,-40.56,;36.6,-42.05,;34.49,-42.13,;32.98,-41.83,;31.97,-42.99,;32.47,-44.45,;31.46,-45.61,;33.99,-44.74,;35,-43.58,)|
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TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548493
PNG
(BAY-784)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1[C@@H](C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(cc1Cl)C(F)(F)F
PDB

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n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Tag-lite green-labeled agonist binding to terbium fluorophore-labeled human N-terminal SNAP-tag GnRh receptor expressed in HEK293 cells...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548473
PNG
(CHEMBL4740373)
Show SMILES CC1N(c2ccc(cc2C11CCNCC1)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548473
PNG
(CHEMBL4740373)
Show SMILES CC1N(c2ccc(cc2C11CCNCC1)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
KEGG

UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
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n/an/a 28n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
PDB

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PubMed
n/an/a 28n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
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n/an/a 29n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548474
PNG
(CHEMBL4779806)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1
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n/an/a 34n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548472
PNG
(CHEMBL4749790)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
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n/an/a 34n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins foll...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548471
PNG
(CHEMBL4782228)
Show SMILES CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ncccc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 35n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548469
PNG
(CHEMBL4762368)
Show SMILES [O-][S+]1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(35.81,-1.68,;35.41,-3.17,;36.5,-4.27,;36.11,-5.75,;34.63,-6.15,;33.53,-5.08,;33.93,-3.59,;35.55,-7.39,;37.09,-7.37,;38.44,-8.13,;38.42,-6.58,;34.66,-8.66,;33.18,-8.2,;31.84,-8.97,;30.51,-8.21,;30.51,-6.67,;29.17,-5.91,;27.84,-6.68,;27.85,-8.22,;26.5,-5.92,;26.5,-4.38,;25.17,-3.62,;23.83,-4.39,;23.85,-5.94,;25.18,-6.7,;31.83,-5.89,;33.16,-6.65,;35.15,-10.11,;36.63,-9.71,;36.24,-11.2,;34.14,-11.27,;32.63,-10.97,;31.61,-12.13,;32.11,-13.59,;31.1,-14.76,;33.63,-13.89,;34.64,-12.72,)|
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n/an/a 36n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548478
PNG
(CHEMBL4746174)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccc(F)cc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 38n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548458
PNG
(CHEMBL4756920)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
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n/an/a 40n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548458
PNG
(CHEMBL4756920)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
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n/an/a 40n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548468
PNG
(CHEMBL4747322)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(NC(=O)c3cccnc3)ccc12
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n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548483
PNG
(CHEMBL4761024)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 47n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548465
PNG
(CHEMBL4745391)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCSCC2)c2cc(NC(=O)c3cccnc3)ccc12
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n/an/a 48n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548484
PNG
(CHEMBL4740379)
Show SMILES CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccccc1
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n/an/a 53n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548464
PNG
(CHEMBL4793643)
Show SMILES CC1N(c2ccc(NC(=O)c3cccnc3)cc2C11CCOCC1)S(=O)(=O)c1ccc(F)cc1
PDB

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n/an/a 53n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50041550
PNG
(CHEMBL3358413)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(Cl)cc1C(F)(F)F
Show InChI InChI=1S/C29H26ClF4N3O5S2/c30-19-14-22(29(32,33)34)24(35-15-19)16-36-27(38)18-3-8-25-23(13-18)28(9-11-43(39,40)12-10-28)26(17-1-2-17)37(25)44(41,42)21-6-4-20(31)5-7-21/h3-8,13-15,17,26H,1-2,9-12,16H2,(H,36,38)
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Article
PubMed
n/an/a 54n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548471
PNG
(CHEMBL4782228)
Show SMILES CC1N(c2ccc(cc2C11CCN(CC1)C(C)=O)C(=O)NCc1ncccc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 54n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548477
PNG
(CHEMBL4760799)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NC1(CC1)c1ccc(Cl)cc1)S(=O)(=O)c1ccc(F)cc1
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n/an/a 56n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548458
PNG
(CHEMBL4756920)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
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n/an/a 60n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548458
PNG
(CHEMBL4756920)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
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n/an/a 60n/an/an/an/an/an/a


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Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548458
PNG
(CHEMBL4756920)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncccc1Cl
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n/an/a 60n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548467
PNG
(CHEMBL4787856)
Show SMILES OC1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(36.16,-32.54,;35.77,-34.03,;36.86,-35.12,;36.47,-36.6,;34.98,-37.01,;33.89,-35.93,;34.29,-34.44,;35.91,-38.25,;37.45,-38.23,;38.8,-38.98,;38.77,-37.44,;35.02,-39.51,;33.54,-39.05,;32.2,-39.83,;30.86,-39.06,;30.86,-37.52,;29.53,-36.76,;28.2,-37.54,;28.2,-39.08,;26.86,-36.77,;26.86,-35.24,;25.52,-34.47,;24.19,-35.25,;24.2,-36.8,;25.54,-37.55,;32.18,-36.75,;33.52,-37.5,;35.51,-40.97,;36.99,-40.56,;36.6,-42.05,;34.49,-42.13,;32.98,-41.83,;31.97,-42.99,;32.47,-44.45,;31.46,-45.61,;33.99,-44.74,;35,-43.58,)|
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n/an/a 61n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548461
PNG
(CHEMBL4751345)
Show SMILES Fc1ccc(cc1)S(=O)(=O)N1C(C2CC2)C2(CCS(=O)(=O)CC2)c2cc(ccc12)C(=O)NCc1ncc(F)cc1Cl
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n/an/a 65n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548474
PNG
(CHEMBL4779806)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1
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n/an/a 68n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)
BDBM50548489
PNG
(CHEMBL4798298)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1C(C)Cc2cc(ccc12)C(=O)NCc1ccccc1Cl
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n/an/a 72n/an/an/an/an/an/a


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Assay Description
Antagonist activity at rat GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followed ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548478
PNG
(CHEMBL4746174)
Show SMILES CC(=O)N1CCC2(CC1)C(C1CC1)N(c1ccc(cc21)C(=O)NCc1ccc(F)cc1Cl)S(=O)(=O)c1ccc(F)cc1
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n/an/a 77n/an/an/an/an/an/a


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Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of buserelin-induced response preincubated for 20 mins fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50548466
PNG
(CHEMBL4757424)
Show SMILES OC1(CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1)C(F)(F)F |(57.14,-3.38,;56.05,-4.48,;57.14,-5.57,;56.75,-7.05,;55.26,-7.46,;54.16,-6.38,;54.56,-4.89,;56.19,-8.7,;57.73,-8.68,;59.07,-9.43,;59.05,-7.89,;55.29,-9.96,;53.81,-9.5,;52.47,-10.28,;51.14,-9.51,;51.14,-7.98,;49.8,-7.21,;48.47,-7.99,;48.48,-9.53,;47.13,-7.22,;47.13,-5.69,;45.8,-4.92,;44.47,-5.7,;44.48,-7.25,;45.82,-8.01,;52.46,-7.2,;53.8,-7.96,;55.78,-11.42,;57.27,-11.01,;56.87,-12.5,;54.77,-12.58,;53.26,-12.28,;52.24,-13.44,;52.74,-14.9,;51.73,-16.06,;54.27,-15.19,;55.27,-14.03,;55.64,-2.99,;56.73,-1.89,;54.15,-2.59,;55.24,-1.49,)|
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n/an/a 78n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human GnRH receptor expressed in CHO-K1 cells assessed as inhibition of LHRH-induced response preincubated for 20 mins followe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01076
BindingDB Entry DOI: 10.7270/Q26D5XK9
More data for this
Ligand-Target Pair
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