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PubMed code 24602401

Compile data set for download or QSAR
Found 40 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
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008834
PNG
(CHEMBL3236671)
Show SMILES Cc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H52N8O6/c1-19-9-7-10-20(2)25(19)18-29(32(46)41-28(33(47)48)11-5-6-13-35)42-31(45)27(12-8-14-39-34(37)38)40-30(44)26(36)17-24-21(3)15-23(43)16-22(24)4/h7,9-10,15-16,26-29,43H,5-6,8,11-14,17-18,35-36H2,1-4H3,(H,40,44)(H,41,46)(H,42,45)(H,47,48)(H4,37,38,39)/t26-,27+,28-,29-/m0/s1
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 0.00935n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008837
PNG
(CHEMBL3236674)
Show SMILES CCc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C35H54N8O6/c1-5-23-11-8-10-20(2)26(23)19-30(33(47)42-29(34(48)49)12-6-7-14-36)43-32(46)28(13-9-15-40-35(38)39)41-31(45)27(37)18-25-21(3)16-24(44)17-22(25)4/h8,10-11,16-17,27-30,44H,5-7,9,12-15,18-19,36-37H2,1-4H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 0.0958n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008840
PNG
(CHEMBL3236677)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H49N9O6/c1-19-14-22(44)15-20(2)24(19)17-25(36)30(45)41-27(11-7-13-39-34(37)38)31(46)43-29(16-21-18-40-26-9-4-3-8-23(21)26)32(47)42-28(33(48)49)10-5-6-12-35/h3-4,8-9,14-15,18,25,27-29,40,44H,5-7,10-13,16-17,35-36H2,1-2H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,37,38,39)/t25-,27+,28-,29-/m0/s1
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 0.0991n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008838
PNG
(CHEMBL3236675)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-17-25(45)18-22(2)27(21)20-28(38)32(46)42-29(14-8-16-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)13-5-6-15-37)19-24-11-7-10-23-9-3-4-12-26(23)24/h3-4,7,9-12,17-18,28-31,45H,5-6,8,13-16,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 0.109n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008841
PNG
(CHEMBL3236678)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C32H48N8O6/c1-19-15-22(41)16-20(2)23(19)18-24(34)28(42)38-25(12-8-14-37-32(35)36)29(43)40-27(17-21-9-4-3-5-10-21)30(44)39-26(31(45)46)11-6-7-13-33/h3-5,9-10,15-16,24-27,41H,6-8,11-14,17-18,33-34H2,1-2H3,(H,38,42)(H,39,44)(H,40,43)(H,45,46)(H4,35,36,37)/t24-,25+,26-,27-/m0/s1
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 0.143n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008836
PNG
(CHEMBL3236673)
Show SMILES CC(C)c1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H56N8O6/c1-20(2)25-11-8-10-21(3)27(25)19-31(34(48)43-30(35(49)50)12-6-7-14-37)44-33(47)29(13-9-15-41-36(39)40)42-32(46)28(38)18-26-22(4)16-24(45)17-23(26)5/h8,10-11,16-17,20,28-31,45H,6-7,9,12-15,18-19,37-38H2,1-5H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 0.155n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008835
PNG
(CHEMBL3236672)
Show SMILES Cc1cc(C)c(C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCCN)C(O)=O)c(C)c1 |r|
Show InChI InChI=1S/C35H54N8O6/c1-19-13-20(2)26(21(3)14-19)18-30(33(47)42-29(34(48)49)9-6-7-11-36)43-32(46)28(10-8-12-40-35(38)39)41-31(45)27(37)17-25-22(4)15-24(44)16-23(25)5/h13-16,27-30,44H,6-12,17-18,36-37H2,1-5H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 0.158n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008839
PNG
(CHEMBL3236676)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-16-26(45)17-22(2)27(21)20-28(38)32(46)42-29(11-7-15-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)10-5-6-14-37)19-23-12-13-24-8-3-4-9-25(24)18-23/h3-4,8-9,12-13,16-18,28-31,45H,5-7,10-11,14-15,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 0.235n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008836
PNG
(CHEMBL3236673)
Show SMILES CC(C)c1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H56N8O6/c1-20(2)25-11-8-10-21(3)27(25)19-31(34(48)43-30(35(49)50)12-6-7-14-37)44-33(47)29(13-9-15-41-36(39)40)42-32(46)28(38)18-26-22(4)16-24(45)17-23(26)5/h8,10-11,16-17,20,28-31,45H,6-7,9,12-15,18-19,37-38H2,1-5H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 0.236n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008837
PNG
(CHEMBL3236674)
Show SMILES CCc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C35H54N8O6/c1-5-23-11-8-10-20(2)26(23)19-30(33(47)42-29(34(48)49)12-6-7-14-36)43-32(46)28(13-9-15-40-35(38)39)41-31(45)27(37)18-25-21(3)16-24(44)17-22(25)4/h8,10-11,16-17,27-30,44H,5-7,9,12-15,18-19,36-37H2,1-4H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 0.961n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008838
PNG
(CHEMBL3236675)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-17-25(45)18-22(2)27(21)20-28(38)32(46)42-29(14-8-16-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)13-5-6-15-37)19-24-11-7-10-23-9-3-4-12-26(23)24/h3-4,7,9-12,17-18,28-31,45H,5-6,8,13-16,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 1.60n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008834
PNG
(CHEMBL3236671)
Show SMILES Cc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H52N8O6/c1-19-9-7-10-20(2)25(19)18-29(32(46)41-28(33(47)48)11-5-6-13-35)42-31(45)27(12-8-14-39-34(37)38)40-30(44)26(36)17-24-21(3)15-23(43)16-22(24)4/h7,9-10,15-16,26-29,43H,5-6,8,11-14,17-18,35-36H2,1-4H3,(H,40,44)(H,41,46)(H,42,45)(H,47,48)(H4,37,38,39)/t26-,27+,28-,29-/m0/s1
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 4.70n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008840
PNG
(CHEMBL3236677)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H49N9O6/c1-19-14-22(44)15-20(2)24(19)17-25(36)30(45)41-27(11-7-13-39-34(37)38)31(46)43-29(16-21-18-40-26-9-4-3-8-23(21)26)32(47)42-28(33(48)49)10-5-6-12-35/h3-4,8-9,14-15,18,25,27-29,40,44H,5-7,10-13,16-17,35-36H2,1-2H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,37,38,39)/t25-,27+,28-,29-/m0/s1
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 17n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008839
PNG
(CHEMBL3236676)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-16-26(45)17-22(2)27(21)20-28(38)32(46)42-29(11-7-15-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)10-5-6-14-37)19-23-12-13-24-8-3-4-9-25(24)18-23/h3-4,8-9,12-13,16-18,28-31,45H,5-7,10-11,14-15,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 19n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008841
PNG
(CHEMBL3236678)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C32H48N8O6/c1-19-15-22(41)16-20(2)23(19)18-24(34)28(42)38-25(12-8-14-37-32(35)36)29(43)40-27(17-21-9-4-3-5-10-21)30(44)39-26(31(45)46)11-6-7-13-33/h3-5,9-10,15-16,24-27,41H,6-8,11-14,17-18,33-34H2,1-2H3,(H,38,42)(H,39,44)(H,40,43)(H,45,46)(H4,35,36,37)/t24-,25+,26-,27-/m0/s1
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 22n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50008835
PNG
(CHEMBL3236672)
Show SMILES Cc1cc(C)c(C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCCN)C(O)=O)c(C)c1 |r|
Show InChI InChI=1S/C35H54N8O6/c1-19-13-20(2)26(21(3)14-19)18-30(33(47)42-29(34(48)49)9-6-7-11-36)43-32(46)28(10-8-12-40-35(38)39)41-31(45)27(37)17-25-22(4)15-24(44)16-23(25)5/h13-16,27-30,44H,6-12,17-18,36-37H2,1-5H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 48n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008837
PNG
(CHEMBL3236674)
Show SMILES CCc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C35H54N8O6/c1-5-23-11-8-10-20(2)26(23)19-30(33(47)42-29(34(48)49)12-6-7-14-36)43-32(46)28(13-9-15-40-35(38)39)41-31(45)27(37)18-25-21(3)16-24(44)17-22(25)4/h8,10-11,16-17,27-30,44H,5-7,9,12-15,18-19,36-37H2,1-4H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 50n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008836
PNG
(CHEMBL3236673)
Show SMILES CC(C)c1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H56N8O6/c1-20(2)25-11-8-10-21(3)27(25)19-31(34(48)43-30(35(49)50)12-6-7-14-37)44-33(47)29(13-9-15-41-36(39)40)42-32(46)28(38)18-26-22(4)16-24(45)17-23(26)5/h8,10-11,16-17,20,28-31,45H,6-7,9,12-15,18-19,37-38H2,1-5H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 77n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008834
PNG
(CHEMBL3236671)
Show SMILES Cc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H52N8O6/c1-19-9-7-10-20(2)25(19)18-29(32(46)41-28(33(47)48)11-5-6-13-35)42-31(45)27(12-8-14-39-34(37)38)40-30(44)26(36)17-24-21(3)15-23(43)16-22(24)4/h7,9-10,15-16,26-29,43H,5-6,8,11-14,17-18,35-36H2,1-4H3,(H,40,44)(H,41,46)(H,42,45)(H,47,48)(H4,37,38,39)/t26-,27+,28-,29-/m0/s1
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 105n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008838
PNG
(CHEMBL3236675)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-17-25(45)18-22(2)27(21)20-28(38)32(46)42-29(14-8-16-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)13-5-6-15-37)19-24-11-7-10-23-9-3-4-12-26(23)24/h3-4,7,9-12,17-18,28-31,45H,5-6,8,13-16,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 173n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008840
PNG
(CHEMBL3236677)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H49N9O6/c1-19-14-22(44)15-20(2)24(19)17-25(36)30(45)41-27(11-7-13-39-34(37)38)31(46)43-29(16-21-18-40-26-9-4-3-8-23(21)26)32(47)42-28(33(48)49)10-5-6-12-35/h3-4,8-9,14-15,18,25,27-29,40,44H,5-7,10-13,16-17,35-36H2,1-2H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,37,38,39)/t25-,27+,28-,29-/m0/s1
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 186n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008839
PNG
(CHEMBL3236676)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-16-26(45)17-22(2)27(21)20-28(38)32(46)42-29(11-7-15-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)10-5-6-14-37)19-23-12-13-24-8-3-4-9-25(24)18-23/h3-4,8-9,12-13,16-18,28-31,45H,5-7,10-11,14-15,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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 258n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008835
PNG
(CHEMBL3236672)
Show SMILES Cc1cc(C)c(C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCCN)C(O)=O)c(C)c1 |r|
Show InChI InChI=1S/C35H54N8O6/c1-19-13-20(2)26(21(3)14-19)18-30(33(47)42-29(34(48)49)9-6-7-11-36)43-32(46)28(10-8-12-40-35(38)39)41-31(45)27(37)17-25-22(4)15-24(44)16-23(25)5/h13-16,27-30,44H,6-12,17-18,36-37H2,1-5H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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 329n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes after 2 hrs

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50008841
PNG
(CHEMBL3236678)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C32H48N8O6/c1-19-15-22(41)16-20(2)23(19)18-24(34)28(42)38-25(12-8-14-37-32(35)36)29(43)40-27(17-21-9-4-3-5-10-21)30(44)39-26(31(45)46)11-6-7-13-33/h3-5,9-10,15-16,24-27,41H,6-8,11-14,17-18,33-34H2,1-2H3,(H,38,42)(H,39,44)(H,40,43)(H,45,46)(H4,35,36,37)/t24-,25+,26-,27-/m0/s1
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 2.10E+3n/an/an/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008837
PNG
(CHEMBL3236674)
Show SMILES CCc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C35H54N8O6/c1-5-23-11-8-10-20(2)26(23)19-30(33(47)42-29(34(48)49)12-6-7-14-36)43-32(46)28(13-9-15-40-35(38)39)41-31(45)27(37)18-25-21(3)16-24(44)17-22(25)4/h8,10-11,16-17,27-30,44H,5-7,9,12-15,18-19,36-37H2,1-4H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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n/an/a 0.220n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008837
PNG
(CHEMBL3236674)
Show SMILES CCc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C35H54N8O6/c1-5-23-11-8-10-20(2)26(23)19-30(33(47)42-29(34(48)49)12-6-7-14-36)43-32(46)28(13-9-15-40-35(38)39)41-31(45)27(37)18-25-21(3)16-24(44)17-22(25)4/h8,10-11,16-17,27-30,44H,5-7,9,12-15,18-19,36-37H2,1-4H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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n/an/a 0.474n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008838
PNG
(CHEMBL3236675)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-17-25(45)18-22(2)27(21)20-28(38)32(46)42-29(14-8-16-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)13-5-6-15-37)19-24-11-7-10-23-9-3-4-12-26(23)24/h3-4,7,9-12,17-18,28-31,45H,5-6,8,13-16,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 0.755n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008836
PNG
(CHEMBL3236673)
Show SMILES CC(C)c1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H56N8O6/c1-20(2)25-11-8-10-21(3)27(25)19-31(34(48)43-30(35(49)50)12-6-7-14-37)44-33(47)29(13-9-15-41-36(39)40)42-32(46)28(38)18-26-22(4)16-24(45)17-23(26)5/h8,10-11,16-17,20,28-31,45H,6-7,9,12-15,18-19,37-38H2,1-5H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 0.828n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008840
PNG
(CHEMBL3236677)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H49N9O6/c1-19-14-22(44)15-20(2)24(19)17-25(36)30(45)41-27(11-7-13-39-34(37)38)31(46)43-29(16-21-18-40-26-9-4-3-8-23(21)26)32(47)42-28(33(48)49)10-5-6-12-35/h3-4,8-9,14-15,18,25,27-29,40,44H,5-7,10-13,16-17,35-36H2,1-2H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,37,38,39)/t25-,27+,28-,29-/m0/s1
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n/an/a 1.10n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008836
PNG
(CHEMBL3236673)
Show SMILES CC(C)c1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H56N8O6/c1-20(2)25-11-8-10-21(3)27(25)19-31(34(48)43-30(35(49)50)12-6-7-14-37)44-33(47)29(13-9-15-41-36(39)40)42-32(46)28(38)18-26-22(4)16-24(45)17-23(26)5/h8,10-11,16-17,20,28-31,45H,6-7,9,12-15,18-19,37-38H2,1-5H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 1.20n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008841
PNG
(CHEMBL3236678)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C32H48N8O6/c1-19-15-22(41)16-20(2)23(19)18-24(34)28(42)38-25(12-8-14-37-32(35)36)29(43)40-27(17-21-9-4-3-5-10-21)30(44)39-26(31(45)46)11-6-7-13-33/h3-5,9-10,15-16,24-27,41H,6-8,11-14,17-18,33-34H2,1-2H3,(H,38,42)(H,39,44)(H,40,43)(H,45,46)(H4,35,36,37)/t24-,25+,26-,27-/m0/s1
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n/an/a 1.40n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008840
PNG
(CHEMBL3236677)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H49N9O6/c1-19-14-22(44)15-20(2)24(19)17-25(36)30(45)41-27(11-7-13-39-34(37)38)31(46)43-29(16-21-18-40-26-9-4-3-8-23(21)26)32(47)42-28(33(48)49)10-5-6-12-35/h3-4,8-9,14-15,18,25,27-29,40,44H,5-7,10-13,16-17,35-36H2,1-2H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,37,38,39)/t25-,27+,28-,29-/m0/s1
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n/an/a 1.70n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008834
PNG
(CHEMBL3236671)
Show SMILES Cc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H52N8O6/c1-19-9-7-10-20(2)25(19)18-29(32(46)41-28(33(47)48)11-5-6-13-35)42-31(45)27(12-8-14-39-34(37)38)40-30(44)26(36)17-24-21(3)15-23(43)16-22(24)4/h7,9-10,15-16,26-29,43H,5-6,8,11-14,17-18,35-36H2,1-4H3,(H,40,44)(H,41,46)(H,42,45)(H,47,48)(H4,37,38,39)/t26-,27+,28-,29-/m0/s1
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n/an/a 1.70n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008838
PNG
(CHEMBL3236675)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-17-25(45)18-22(2)27(21)20-28(38)32(46)42-29(14-8-16-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)13-5-6-15-37)19-24-11-7-10-23-9-3-4-12-26(23)24/h3-4,7,9-12,17-18,28-31,45H,5-6,8,13-16,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 1.90n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008834
PNG
(CHEMBL3236671)
Show SMILES Cc1cccc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C34H52N8O6/c1-19-9-7-10-20(2)25(19)18-29(32(46)41-28(33(47)48)11-5-6-13-35)42-31(45)27(12-8-14-39-34(37)38)40-30(44)26(36)17-24-21(3)15-23(43)16-22(24)4/h7,9-10,15-16,26-29,43H,5-6,8,11-14,17-18,35-36H2,1-4H3,(H,40,44)(H,41,46)(H,42,45)(H,47,48)(H4,37,38,39)/t26-,27+,28-,29-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008835
PNG
(CHEMBL3236672)
Show SMILES Cc1cc(C)c(C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCCN)C(O)=O)c(C)c1 |r|
Show InChI InChI=1S/C35H54N8O6/c1-19-13-20(2)26(21(3)14-19)18-30(33(47)42-29(34(48)49)9-6-7-11-36)43-32(46)28(10-8-12-40-35(38)39)41-31(45)27(37)17-25-22(4)15-24(44)16-23(25)5/h13-16,27-30,44H,6-12,17-18,36-37H2,1-5H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008835
PNG
(CHEMBL3236672)
Show SMILES Cc1cc(C)c(C[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2c(C)cc(O)cc2C)C(=O)N[C@@H](CCCCN)C(O)=O)c(C)c1 |r|
Show InChI InChI=1S/C35H54N8O6/c1-19-13-20(2)26(21(3)14-19)18-30(33(47)42-29(34(48)49)9-6-7-11-36)43-32(46)28(10-8-12-40-35(38)39)41-31(45)27(37)17-25-22(4)15-24(44)16-23(25)5/h13-16,27-30,44H,6-12,17-18,36-37H2,1-5H3,(H,41,45)(H,42,47)(H,43,46)(H,48,49)(H4,38,39,40)/t27-,28+,29-,30-/m0/s1
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n/an/a 19n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008841
PNG
(CHEMBL3236678)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C32H48N8O6/c1-19-15-22(41)16-20(2)23(19)18-24(34)28(42)38-25(12-8-14-37-32(35)36)29(43)40-27(17-21-9-4-3-5-10-21)30(44)39-26(31(45)46)11-6-7-13-33/h3-5,9-10,15-16,24-27,41H,6-8,11-14,17-18,33-34H2,1-2H3,(H,38,42)(H,39,44)(H,40,43)(H,45,46)(H4,35,36,37)/t24-,25+,26-,27-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50008839
PNG
(CHEMBL3236676)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-16-26(45)17-22(2)27(21)20-28(38)32(46)42-29(11-7-15-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)10-5-6-14-37)19-23-12-13-24-8-3-4-9-25(24)18-23/h3-4,8-9,12-13,16-18,28-31,45H,5-7,10-11,14-15,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 65n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50008839
PNG
(CHEMBL3236676)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C36H50N8O6/c1-21-16-26(45)17-22(2)27(21)20-28(38)32(46)42-29(11-7-15-41-36(39)40)33(47)44-31(34(48)43-30(35(49)50)10-5-6-14-37)19-23-12-13-24-8-3-4-9-25(24)18-23/h3-4,8-9,12-13,16-18,28-31,45H,5-7,10-11,14-15,19-20,37-38H2,1-2H3,(H,42,46)(H,43,48)(H,44,47)(H,49,50)(H4,39,40,41)/t28-,29+,30-,31-/m0/s1
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n/an/a 72n/an/an/an/an/an/a



Nanjing Medical University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction

Bioorg Med Chem 22: 2333-8 (2014)


Article DOI: 10.1016/j.bmc.2014.02.011
BindingDB Entry DOI: 10.7270/Q20P11JG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%