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Compile Data Set for Download or QSAR

Found 63 hits Enz. Inhib. hit(s) with all data for entry = 50013734   
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
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50569110
PNG
(CHEMBL4852403)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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35n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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44n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50569112
PNG
(CHEMBL4865663)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(C)cc12 |c:4,t:8|
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57n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50122054
PNG
(8-Chloro-11-piperazin-1-yl-5H-dibenzo[b,e][1,4]dia...)
Show SMILES Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1 |c:13|
Show InChI InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
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80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50569113
PNG
(CHEMBL4868181)
Show SMILES CCc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50569111
PNG
(CHEMBL4873426)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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95n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569117
PNG
(CHEMBL4875709)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(F)ccc2Nc2ccc(Cl)cc12 |c:4,t:8|
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108n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569113
PNG
(CHEMBL4868181)
Show SMILES CCc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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274n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569116
PNG
(CHEMBL4855524)
Show SMILES COc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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329n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569114
PNG
(CHEMBL4853957)
Show SMILES CCN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:5,t:9|
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340n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50547398
PNG
(CHEMBL4748915)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |c:4,t:8|
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380n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D1 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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389n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569110
PNG
(CHEMBL4852403)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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410n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569111
PNG
(CHEMBL4873426)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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447n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50122054
PNG
(8-Chloro-11-piperazin-1-yl-5H-dibenzo[b,e][1,4]dia...)
Show SMILES Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1 |c:13|
Show InChI InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
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489n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569112
PNG
(CHEMBL4865663)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(C)cc12 |c:4,t:8|
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694n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50569119
PNG
(CHEMBL4856628)
Show SMILES Cc1ccc2Nc3ccc(F)cc3C(=Nc2c1)C1=CCNCC1 |c:14,t:20|
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848n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50547398
PNG
(CHEMBL4748915)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |c:4,t:8|
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1.39E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human D2 receptor expressed in CHO cells assessed as inhibition of dopamine-induced calcium accumulation


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569112
PNG
(CHEMBL4865663)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(C)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569113
PNG
(CHEMBL4868181)
Show SMILES CCc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569116
PNG
(CHEMBL4855524)
Show SMILES COc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569117
PNG
(CHEMBL4875709)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(F)ccc2Nc2ccc(Cl)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569118
PNG
(CHEMBL4849385)
Show SMILES Fc1ccc2Nc3ccc(Cl)cc3N=C(C3=CCNCC3)c2c1 |t:14,16|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50569119
PNG
(CHEMBL4856628)
Show SMILES Cc1ccc2Nc3ccc(F)cc3C(=Nc2c1)C1=CCNCC1 |c:14,t:20|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50122054
PNG
(8-Chloro-11-piperazin-1-yl-5H-dibenzo[b,e][1,4]dia...)
Show SMILES Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1 |c:13|
Show InChI InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50569110
PNG
(CHEMBL4852403)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50547398
PNG
(CHEMBL4748915)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50569111
PNG
(CHEMBL4873426)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50569118
PNG
(CHEMBL4849385)
Show SMILES Fc1ccc2Nc3ccc(Cl)cc3N=C(C3=CCNCC3)c2c1 |t:14,16|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50569119
PNG
(CHEMBL4856628)
Show SMILES Cc1ccc2Nc3ccc(F)cc3C(=Nc2c1)C1=CCNCC1 |c:14,t:20|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50122054
PNG
(8-Chloro-11-piperazin-1-yl-5H-dibenzo[b,e][1,4]dia...)
Show SMILES Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1 |c:13|
Show InChI InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
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n/an/an/an/a 670n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50569110
PNG
(CHEMBL4852403)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50547398
PNG
(CHEMBL4748915)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |c:4,t:8|
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n/an/an/an/a 640n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50569111
PNG
(CHEMBL4873426)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50569118
PNG
(CHEMBL4849385)
Show SMILES Fc1ccc2Nc3ccc(Cl)cc3N=C(C3=CCNCC3)c2c1 |t:14,16|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50569119
PNG
(CHEMBL4856628)
Show SMILES Cc1ccc2Nc3ccc(F)cc3C(=Nc2c1)C1=CCNCC1 |c:14,t:20|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |t:8|
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50122054
PNG
(8-Chloro-11-piperazin-1-yl-5H-dibenzo[b,e][1,4]dia...)
Show SMILES Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCNCC1 |c:13|
Show InChI InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569110
PNG
(CHEMBL4852403)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569114
PNG
(CHEMBL4853957)
Show SMILES CCN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:5,t:9|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569115
PNG
(CHEMBL4879218)
Show SMILES CC(C)N1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccc(F)cc12 |c:6,t:10|
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TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50547398
PNG
(CHEMBL4748915)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569111
PNG
(CHEMBL4873426)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(F)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569112
PNG
(CHEMBL4865663)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(C)ccc2Nc2ccc(C)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569113
PNG
(CHEMBL4868181)
Show SMILES CCc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569116
PNG
(CHEMBL4855524)
Show SMILES COc1ccc2Nc3ccc(C)cc3N=C(C3=CCN(C)CC3)c2c1 |t:15,17|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569117
PNG
(CHEMBL4875709)
Show SMILES CN1CCC(=CC1)C1=Nc2cc(F)ccc2Nc2ccc(Cl)cc12 |c:4,t:8|
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n/an/an/an/a>1.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50569118
PNG
(CHEMBL4849385)
Show SMILES Fc1ccc2Nc3ccc(Cl)cc3N=C(C3=CCNCC3)c2c1 |t:14,16|
PDB

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


TBA

Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin) expressed in CHO cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127911
BindingDB Entry DOI: 10.7270/Q2C82F2T
More data for this
Ligand-Target Pair
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