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PubMed code 25901762

Compile data set for download or QSAR
Found 33 hits of Enzyme Inhibition Constant Data   
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
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087826
PNG
(CHEMBL3426789)
Show SMILES Cc1ccccc1COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)OC2=C1C(=O)CC(C)(C)C2 |c:29,t:18|
Show InChI InChI=1S/C31H34O4/c1-19-8-6-7-9-21(19)18-34-22-12-10-20(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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 3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor expressed in CHO cell membranes assessed as TAN67 Ki at 10 uM after 90 mins by [3H]-dip...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087826
PNG
(CHEMBL3426789)
Show SMILES Cc1ccccc1COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)OC2=C1C(=O)CC(C)(C)C2 |c:29,t:18|
Show InChI InChI=1S/C31H34O4/c1-19-8-6-7-9-21(19)18-34-22-12-10-20(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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 5n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor expressed in CHO cell membranes assessed as SNC80 Ki at 10 uM after 90 mins by [3H]-dip...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087826
PNG
(CHEMBL3426789)
Show SMILES Cc1ccccc1COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)OC2=C1C(=O)CC(C)(C)C2 |c:29,t:18|
Show InChI InChI=1S/C31H34O4/c1-19-8-6-7-9-21(19)18-34-22-12-10-20(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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 7n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor expressed in CHO cell membranes assessed as leu-enkephalin Ki at 10 uM after 90 mins by...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087835
PNG
(CHEMBL3426788)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H32O4/c1-29(2)14-22(31)27-24(16-29)34-25-17-30(3,4)15-23(32)28(25)26(27)20-10-12-21(13-11-20)33-18-19-8-6-5-7-9-19/h5-13,26H,14-18H2,1-4H3
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n/an/an/an/a 200n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087820
PNG
(CHEMBL3426797)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3Br)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31BrO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087825
PNG
(CHEMBL3426790)
Show SMILES Cc1cccc(COc2ccc(cc2)C2C3=C(CC(C)(C)CC3=O)OC3=C2C(=O)CC(C)(C)C3)c1 |c:27,t:16|
Show InChI InChI=1S/C31H34O4/c1-19-7-6-8-20(13-19)18-34-22-11-9-21(10-12-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 3.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087838
PNG
(CHEMBL3426802)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3C(F)(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H31F3O4/c1-29(2)13-22(35)27-24(15-29)38-25-16-30(3,4)14-23(36)28(25)26(27)18-9-11-20(12-10-18)37-17-19-7-5-6-8-21(19)31(32,33)34/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087817
PNG
(CHEMBL3426794)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccc(F)cc3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)19-7-11-21(12-8-19)34-17-18-5-9-20(31)10-6-18/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 100n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087825
PNG
(CHEMBL3426790)
Show SMILES Cc1cccc(COc2ccc(cc2)C2C3=C(CC(C)(C)CC3=O)OC3=C2C(=O)CC(C)(C)C3)c1 |c:27,t:16|
Show InChI InChI=1S/C31H34O4/c1-19-7-6-8-20(13-19)18-34-22-11-9-21(10-12-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 200n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087814
PNG
(CHEMBL3426791)
Show SMILES Cc1ccc(COc2ccc(cc2)C2C3=C(CC(C)(C)CC3=O)OC3=C2C(=O)CC(C)(C)C3)cc1 |c:26,t:15|
Show InChI InChI=1S/C31H34O4/c1-19-6-8-20(9-7-19)18-34-22-12-10-21(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 4.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087822
PNG
(CHEMBL3426799)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3OC(F)(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H31F3O5/c1-29(2)13-21(35)27-24(15-29)38-25-16-30(3,4)14-22(36)28(25)26(27)18-9-11-20(12-10-18)37-17-19-7-5-6-8-23(19)39-31(32,33)34/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087822
PNG
(CHEMBL3426799)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3OC(F)(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H31F3O5/c1-29(2)13-21(35)27-24(15-29)38-25-16-30(3,4)14-22(36)28(25)26(27)18-9-11-20(12-10-18)37-17-19-7-5-6-8-23(19)39-31(32,33)34/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 300n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087818
PNG
(CHEMBL3426795)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3Cl)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31ClO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087835
PNG
(CHEMBL3426788)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H32O4/c1-29(2)14-22(31)27-24(16-29)34-25-17-30(3,4)15-23(32)28(25)26(27)20-10-12-21(13-11-20)33-18-19-8-6-5-7-9-19/h5-13,26H,14-18H2,1-4H3
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n/an/an/an/a 6.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087816
PNG
(CHEMBL3426793)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3cccc(F)c3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)19-8-10-21(11-9-19)34-17-18-6-5-7-20(31)12-18/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087815
PNG
(CHEMBL3426792)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 100n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087839
PNG
(CHEMBL3426801)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3CO)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H34O5/c1-30(2)13-23(33)28-25(15-30)36-26-16-31(3,4)14-24(34)29(26)27(28)19-9-11-22(12-10-19)35-18-21-8-6-5-7-20(21)17-32/h5-12,27,32H,13-18H2,1-4H3
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n/an/an/an/a 1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087824
PNG
(CHEMBL3426800)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3S(C)(=O)=O)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H34O6S/c1-30(2)14-22(32)28-24(16-30)37-25-17-31(3,4)15-23(33)29(25)27(28)19-10-12-21(13-11-19)36-18-20-8-6-7-9-26(20)38(5,34)35/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 900n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087818
PNG
(CHEMBL3426795)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3Cl)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31ClO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 300n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087814
PNG
(CHEMBL3426791)
Show SMILES Cc1ccc(COc2ccc(cc2)C2C3=C(CC(C)(C)CC3=O)OC3=C2C(=O)CC(C)(C)C3)cc1 |c:26,t:15|
Show InChI InChI=1S/C31H34O4/c1-19-6-8-20(9-7-19)18-34-22-12-10-21(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 300n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087826
PNG
(CHEMBL3426789)
Show SMILES Cc1ccccc1COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)OC2=C1C(=O)CC(C)(C)C2 |c:29,t:18|
Show InChI InChI=1S/C31H34O4/c1-19-8-6-7-9-21(19)18-34-22-12-10-20(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 30n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087816
PNG
(CHEMBL3426793)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3cccc(F)c3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)19-8-10-21(11-9-19)34-17-18-6-5-7-20(31)12-18/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 7.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087826
PNG
(CHEMBL3426789)
Show SMILES Cc1ccccc1COc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)OC2=C1C(=O)CC(C)(C)C2 |c:29,t:18|
Show InChI InChI=1S/C31H34O4/c1-19-8-6-7-9-21(19)18-34-22-12-10-20(11-13-22)27-28-23(32)14-30(2,3)16-25(28)35-26-17-31(4,5)15-24(33)29(26)27/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 2.60E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087821
PNG
(CHEMBL3426798)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3OC(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H32F2O5/c1-30(2)13-21(34)27-24(15-30)37-25-16-31(3,4)14-22(35)28(25)26(27)18-9-11-20(12-10-18)36-17-19-7-5-6-8-23(19)38-29(32)33/h5-12,26,29H,13-17H2,1-4H3
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n/an/an/an/a 200n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087819
PNG
(CHEMBL3426796)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3cccc(Cl)c3Cl)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H30Cl2O4/c1-29(2)12-21(33)26-23(14-29)36-24-15-30(3,4)13-22(34)27(24)25(26)17-8-10-19(11-9-17)35-16-18-6-5-7-20(31)28(18)32/h5-11,25H,12-16H2,1-4H3
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n/an/an/an/a 100n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087817
PNG
(CHEMBL3426794)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccc(F)cc3)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)19-7-11-21(12-8-19)34-17-18-5-9-20(31)10-6-18/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087821
PNG
(CHEMBL3426798)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3OC(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H32F2O5/c1-30(2)13-21(34)27-24(15-30)37-25-16-31(3,4)14-22(35)28(25)26(27)18-9-11-20(12-10-18)36-17-19-7-5-6-8-23(19)38-29(32)33/h5-12,26,29H,13-17H2,1-4H3
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n/an/an/an/a 3.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087839
PNG
(CHEMBL3426801)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3CO)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H34O5/c1-30(2)13-23(33)28-25(15-30)36-26-16-31(3,4)14-24(34)29(26)27(28)19-9-11-22(12-10-19)35-18-21-8-6-5-7-20(21)17-32/h5-12,27,32H,13-18H2,1-4H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50087820
PNG
(CHEMBL3426797)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3Br)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31BrO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 50n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human delta opioid receptor-1 expressed in CHO cells assessed as potentiation of leu-enkephalin-induced response af...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087824
PNG
(CHEMBL3426800)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3S(C)(=O)=O)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H34O6S/c1-30(2)14-22(32)28-24(16-30)37-25-17-31(3,4)15-23(33)29(25)27(28)19-10-12-21(13-11-19)36-18-20-8-6-7-9-26(20)38(5,34)35/h6-13,27H,14-18H2,1-5H3
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n/an/an/an/a 5.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087838
PNG
(CHEMBL3426802)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3C(F)(F)F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C31H31F3O4/c1-29(2)13-22(35)27-24(15-29)38-25-16-30(3,4)14-23(36)28(25)26(27)18-9-11-20(12-10-18)37-17-19-7-5-6-8-21(19)31(32,33)34/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087815
PNG
(CHEMBL3426792)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3ccccc3F)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H31FO4/c1-29(2)13-22(32)27-24(15-29)35-25-16-30(3,4)14-23(33)28(25)26(27)18-9-11-20(12-10-18)34-17-19-7-5-6-8-21(19)31/h5-12,26H,13-17H2,1-4H3
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n/an/an/an/a 5.00E+3n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50087819
PNG
(CHEMBL3426796)
Show SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(OCc3cccc(Cl)c3Cl)cc2)C(=O)CC(C)(C)C1 |c:6,11|
Show InChI InChI=1S/C30H30Cl2O4/c1-29(2)12-21(33)26-23(14-29)36-24-15-30(3,4)13-22(34)27(24)25(26)17-8-10-19(11-9-17)35-16-18-6-5-7-20(31)28(18)32/h5-11,25H,12-16H2,1-4H3
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n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mu opioid receptor-1 expressed in CHO cells assessed as potentiation of endomorphin 1-induced response after ...

J Med Chem 58: 4220-9 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00007
BindingDB Entry DOI: 10.7270/Q27P9149
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%