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Compile Data Set for Download or QSAR

Found 57 hits with Last Name = 'carlton' and Initial = 'mbl'   
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
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582430
PNG
(CHEMBL4598390)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c(F)c1
UniProtKB/SwissProt

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7n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H-RL338 from human GPR6 expressed in T-REx-CHO-GPR6 cells assessed as inhibition constant by competition binding assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582450
PNG
(CHEMBL4778540)
Show SMILES CC(=O)N1CCc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(N[C@@H]3CCOC3)nc2C1 |r|
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9.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H-RL338 from human GPR6 expressed in T-REx-CHO-GPR6 cells assessed as inhibition constant by competition binding assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582449
PNG
(CHEMBL5093828)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:9|
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16n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H-RL338 from human GPR6 expressed in T-REx-CHO-GPR6 cells assessed as inhibition constant by competition binding assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582430
PNG
(CHEMBL4598390)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c(F)c1
PDB

UniProtKB/SwissProt

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n/an/a 50n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582429
PNG
(CHEMBL3719536)
Show SMILES Fc1ccc(F)c(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c1
PDB

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n/an/a 126n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582441
PNG
(CHEMBL5076483)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCN(Cc2ccc(F)cc2F)CC1)S(C)(=O)=O |c:9|
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n/an/a 2.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin) over CYP1A2


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50582450
PNG
(CHEMBL4778540)
Show SMILES CC(=O)N1CCc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(N[C@@H]3CCOC3)nc2C1 |r|
PDB
MMDB

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PubMed
n/an/a 3.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human ERG


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582449
PNG
(CHEMBL5093828)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:9|
PDB

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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582431
PNG
(CHEMBL4756097)
Show SMILES Cc1cc2nc(NC3CC3)c(nc2cn1)N1CCN(Cc2ccc(F)cc2F)CC1
PDB

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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582433
PNG
(CHEMBL4763822)
Show SMILES CC(C)Nc1nc2cc(C)ncc2nc1N1CCN(Cc2ccc(F)cc2F)CC1
PDB

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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582444
PNG
(CHEMBL5081373)
Show SMILES CC(C)Nc1nc2CNC=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F |c:9|
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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582438
PNG
(CHEMBL4789388)
Show SMILES CC(C)Nc1nc2cnc(C)cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F
PDB

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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582439
PNG
(CHEMBL5078045)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCN(Cc2ccc(F)cc2F)CC1)C(C)=O |c:9|
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n/an/a 3.98E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50582449
PNG
(CHEMBL5093828)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:9|
PDB
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n/an/a 6.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human ERG


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582434
PNG
(CHEMBL5085738)
Show SMILES Cc1cc2nc(NC3CC3)c(nc2cn1)N1CCC(CC1)Oc1ccc(F)cc1F
PDB

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n/an/a 6.31E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582435
PNG
(CHEMBL4762823)
Show SMILES CC(C)Nc1nc2cc(C)ncc2nc1N1CCC(CC1)Oc1ccc(F)cc1F
PDB

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n/an/a 6.31E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582437
PNG
(CHEMBL4781329)
Show SMILES Cc1cc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(NC3CC3)nc2cn1
PDB

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n/an/a 6.31E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582443
PNG
(CHEMBL5077087)
Show SMILES CC(=O)N1Cc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(NC3CC3)nc2C=C1 |c:34|
PDB

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n/an/a<6.31E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582447
PNG
(CHEMBL5077658)
Show SMILES COC(=O)N1Cc2nc(NC(C)C)c(nc2C=C1)N1CCC(CC1)Oc1ccc(F)cc1F |c:17|
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n/an/a 7.94E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582440
PNG
(CHEMBL5080655)
Show SMILES CCC(=O)N1Cc2nc(NC(C)C)c(nc2C=C1)N1CCN(Cc2ccc(F)cc2F)CC1 |c:17|
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n/an/a<1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582445
PNG
(CHEMBL5073447)
Show SMILES CC(C)Nc1nc2CN(C)C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F |c:10|
PDB

UniProtKB/SwissProt

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n/an/a<1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582448
PNG
(CHEMBL5074623)
Show SMILES CC(=O)N1Cc2nc(NC3CC3)c(nc2C=C1)N1CCC(CC1)Oc1ccc(F)cc1F |c:17|
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n/an/a<1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582446
PNG
(CHEMBL5081096)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)S(C)(=O)=O |c:9|
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n/an/a<1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50582442
PNG
(CHEMBL5075475)
Show SMILES CC(C)Nc1nc2C=CN(Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:7|
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n/an/a 3.16E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2D6 (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582443
PNG
(CHEMBL5077087)
Show SMILES CC(=O)N1Cc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(NC3CC3)nc2C=C1 |c:34|
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n/an/an/an/a 3.40E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582444
PNG
(CHEMBL5081373)
Show SMILES CC(C)Nc1nc2CNC=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F |c:9|
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n/an/an/an/a 1.00E+5n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582445
PNG
(CHEMBL5073447)
Show SMILES CC(C)Nc1nc2CN(C)C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F |c:10|
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n/an/an/an/a 8.90E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582446
PNG
(CHEMBL5081096)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)S(C)(=O)=O |c:9|
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n/an/an/an/a 6.50E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582447
PNG
(CHEMBL5077658)
Show SMILES COC(=O)N1Cc2nc(NC(C)C)c(nc2C=C1)N1CCC(CC1)Oc1ccc(F)cc1F |c:17|
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n/an/an/an/a 1.58E+5n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582448
PNG
(CHEMBL5074623)
Show SMILES CC(=O)N1Cc2nc(NC3CC3)c(nc2C=C1)N1CCC(CC1)Oc1ccc(F)cc1F |c:17|
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n/an/an/an/a 4.30E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582449
PNG
(CHEMBL5093828)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:9|
UniProtKB/SwissProt

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n/an/an/an/a 3.40E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582450
PNG
(CHEMBL4778540)
Show SMILES CC(=O)N1CCc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(N[C@@H]3CCOC3)nc2C1 |r|
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PubMed
n/an/an/an/a 3.80E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582442
PNG
(CHEMBL5075475)
Show SMILES CC(C)Nc1nc2C=CN(Cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(C)=O |c:7|
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n/an/an/an/a 9.60E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582441
PNG
(CHEMBL5076483)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCN(Cc2ccc(F)cc2F)CC1)S(C)(=O)=O |c:9|
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n/an/an/an/a 2.70E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582440
PNG
(CHEMBL5080655)
Show SMILES CCC(=O)N1Cc2nc(NC(C)C)c(nc2C=C1)N1CCN(Cc2ccc(F)cc2F)CC1 |c:17|
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n/an/an/an/a 3.00E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582439
PNG
(CHEMBL5078045)
Show SMILES CC(C)Nc1nc2CN(C=Cc2nc1N1CCN(Cc2ccc(F)cc2F)CC1)C(C)=O |c:9|
UniProtKB/SwissProt

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n/an/an/an/a 2.70E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582438
PNG
(CHEMBL4789388)
Show SMILES CC(C)Nc1nc2cnc(C)cc2nc1N1CCC(CC1)Oc1ccc(F)cc1F
UniProtKB/SwissProt

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n/an/an/an/a 6.10E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582437
PNG
(CHEMBL4781329)
Show SMILES Cc1cc2nc(N3CCC(CC3)Oc3ccc(F)cc3F)c(NC3CC3)nc2cn1
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n/an/an/an/a 9.50E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582436
PNG
(CHEMBL5078513)
Show SMILES CC(C)Nc1nc2cc(ncc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C#N
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n/an/an/an/a 5.50E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582435
PNG
(CHEMBL4762823)
Show SMILES CC(C)Nc1nc2cc(C)ncc2nc1N1CCC(CC1)Oc1ccc(F)cc1F
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n/an/an/an/a 1.60E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582434
PNG
(CHEMBL5085738)
Show SMILES Cc1cc2nc(NC3CC3)c(nc2cn1)N1CCC(CC1)Oc1ccc(F)cc1F
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n/an/an/an/a 2.90E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582433
PNG
(CHEMBL4763822)
Show SMILES CC(C)Nc1nc2cc(C)ncc2nc1N1CCN(Cc2ccc(F)cc2F)CC1
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n/an/an/an/a 5.10E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582432
PNG
(CHEMBL5080739)
Show SMILES CC(C)Nc1nc2ccncc2nc1N1CCN(Cc2ccc(F)cc2F)CC1
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n/an/an/an/a 2.10E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582431
PNG
(CHEMBL4756097)
Show SMILES Cc1cc2nc(NC3CC3)c(nc2cn1)N1CCN(Cc2ccc(F)cc2F)CC1
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n/an/an/an/a 2.90E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582430
PNG
(CHEMBL4598390)
Show SMILES Fc1ccc(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c(F)c1
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n/an/an/an/a 3.90E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582429
PNG
(CHEMBL3719536)
Show SMILES Fc1ccc(F)c(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c1
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n/an/an/an/a 1.51E+5n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582428
PNG
(CHEMBL3719416)
Show SMILES Fc1ccc(Cl)cc1CN1CCN(CC1)c1nc2cnccc2nc1NC1CC1
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n/an/an/an/a 2.90E+4n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582427
PNG
(CHEMBL3719486)
Show SMILES Clc1ccc(Cl)c(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c1
UniProtKB/SwissProt

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


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582426
PNG
(CHEMBL3719411)
Show SMILES Clc1ccc(Cl)c(CN2CCN(CC2)c2nc3ccncc3nc2NC2CC2)c1
UniProtKB/SwissProt

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n/an/an/an/a 55n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM50582425
PNG
(CHEMBL5077335)
Show SMILES CN(C)C(=O)c1ccc2nc(NC3CC3)c(nc2c1)N1CCN(Cc2cc(Cl)ccc2Cl)CC1
UniProtKB/SwissProt

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n/an/an/an/a 90n/an/an/an/a


TBA

Assay Description
Inverse agonist activity at human GPR6 expressed in CHO-K1 cells assessed as modulation of cAMP level incubated for 20 hrs by TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02081
BindingDB Entry DOI: 10.7270/Q2JW8JSH
More data for this
Ligand-Target Pair
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