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PubMed code 16290934

Compile data set for download or QSAR
Found 51 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


(MOUSE)
BDBM50422795
PNG
(CHEMBL202585)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)CC(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H37N3O4/c1-22-19-35(23(2)18-34(22)20-24-7-4-3-5-8-24)32(26-9-6-10-29(36)16-26)27-12-11-25-13-14-33(21-28(25)15-27)30(37)17-31(38)39/h3-12,15-16,22-23,32,36H,13-14,17-21H2,1-2H3,(H,38,39)/t22-,23+,32+/m1/s1
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n/an/a 0.00100n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422811
PNG
(CHEMBL204716)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)C(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H35N3O4/c1-21-18-34(22(2)17-33(21)19-23-7-4-3-5-8-23)29(25-9-6-10-28(35)16-25)26-12-11-24-13-14-32(20-27(24)15-26)30(36)31(37)38/h3-12,15-16,21-22,29,35H,13-14,17-20H2,1-2H3,(H,37,38)/t21-,22+,29+/m1/s1
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n/an/a 0.00200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422791
PNG
(CHEMBL204480)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CCC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H39N3O3/c1-23-20-35(24(2)19-34(23)21-25-7-4-3-5-8-25)32(27-9-6-10-30(36)18-27)28-12-11-26-13-15-33(16-14-31(37)38)22-29(26)17-28/h3-12,17-18,23-24,32,36H,13-16,19-22H2,1-2H3,(H,37,38)/t23-,24+,32+/m1/s1
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n/an/a 0.00500n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422809
PNG
(CHEMBL204136)
Show SMILES C[C@@H]1CN([C@H](c2ccc(cc2)-c2ccccc2C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C33H34N2O3/c1-23-21-35(24(2)20-34(23)22-25-9-4-3-5-10-25)32(28-11-8-12-29(36)19-28)27-17-15-26(16-18-27)30-13-6-7-14-31(30)33(37)38/h3-19,23-24,32,36H,20-22H2,1-2H3,(H,37,38)/t23-,24+,32-/m1/s1
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n/an/a 0.0200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422804
PNG
(CHEMBL202578)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(26-9-6-10-29(35)16-26)27-12-11-25-13-14-32(21-30(36)37)20-28(25)15-27/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 0.0400n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422803
PNG
(CHEMBL382024)
Show SMILES C[C@@H]1CN([C@H](c2ccc(CCC(O)=O)cc2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C29H34N2O3/c1-21-19-31(22(2)18-30(21)20-24-7-4-3-5-8-24)29(26-9-6-10-27(32)17-26)25-14-11-23(12-15-25)13-16-28(33)34/h3-12,14-15,17,21-22,29,32H,13,16,18-20H2,1-2H3,(H,33,34)/t21-,22+,29-/m1/s1
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n/an/a 0.126n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422808
PNG
(CHEMBL380737)
Show SMILES C[C@@H]1CN([C@H](c2ccc(CC(O)=O)cc2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C28H32N2O3/c1-20-18-30(21(2)17-29(20)19-23-7-4-3-5-8-23)28(25-9-6-10-26(31)16-25)24-13-11-22(12-14-24)15-27(32)33/h3-14,16,20-21,28,31H,15,17-19H2,1-2H3,(H,32,33)/t20-,21+,28-/m1/s1
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n/an/a 0.158n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422793
PNG
(CHEMBL203903)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2ccccc2C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-9-4-3-5-10-26)34(27-11-8-12-31(40)18-27)28-15-16-29-22-38(23-30(29)17-28)35(41)32-13-6-7-14-33(32)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 0.316n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422798
PNG
(CHEMBL201678)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C30H35N3O3/c1-21-16-33(22(2)15-32(21)17-23-7-4-3-5-8-23)30(24-9-6-10-28(34)14-24)25-11-12-26-18-31(20-29(35)36)19-27(26)13-25/h3-14,21-22,30,34H,15-20H2,1-2H3,(H,35,36)/t21-,22+,30+/m1/s1
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n/an/a 0.501n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50039026
PNG
(4-((R)-((2S,5R)-4-allyl-2,5-dimethylpiperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1
Show InChI InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
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n/an/a 0.631n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422796
PNG
(CHEMBL201205)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CCC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(25-9-6-10-29(35)16-25)26-11-12-27-20-32(14-13-30(36)37)21-28(27)15-26/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422801
PNG
(CHEMBL382761)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 1.58n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422792
PNG
(CHEMBL202478)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(27-10-7-11-30(17-27)38-3)28-13-12-26-14-15-33(22-31(36)37)21-29(26)16-28/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422802
PNG
(CHEMBL381385)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc4ccccc4C(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H39N3O3/c1-25-20-39(26(2)19-38(25)21-27-9-4-3-5-10-27)35(28-12-8-13-33(40)18-28)29-15-16-30-22-37(24-32(30)17-29)23-31-11-6-7-14-34(31)36(41)42/h3-18,25-26,35,40H,19-24H2,1-2H3,(H,41,42)/t25-,26+,35+/m1/s1
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n/an/a 3.16n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50422792
PNG
(CHEMBL202478)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(27-10-7-11-30(17-27)38-3)28-13-12-26-14-15-33(22-31(36)37)21-29(26)16-28/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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n/an/a 5n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Binding affinity at human delta opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422810
PNG
(CHEMBL381534)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(Cc2c1)C(=O)c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C37H39N3O4/c1-25-21-40(26(2)20-38(25)22-27-8-5-4-6-9-27)35(30-10-7-11-34(19-30)44-3)31-16-17-32-23-39(24-33(32)18-31)36(41)28-12-14-29(15-13-28)37(42)43/h4-19,25-26,35H,20-24H2,1-3H3,(H,42,43)/t25-,26+,35+/m1/s1
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n/an/a 7.94n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422797
PNG
(CHEMBL380749)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C33H41N3O3/c1-24-21-36(25(2)20-35(24)22-26-8-5-4-6-9-26)33(28-10-7-11-31(19-28)39-3)29-13-12-27-14-16-34(17-15-32(37)38)23-30(27)18-29/h4-13,18-19,24-25,33H,14-17,20-23H2,1-3H3,(H,37,38)/t24-,25+,33+/m1/s1
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n/an/a 12.6n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422800
PNG
(CHEMBL203406)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(Cc2c1)C(=O)CC(O)=O
Show InChI InChI=1S/C33H39N3O4/c1-23-20-36(24(2)19-35(23)21-25-8-5-4-6-9-25)33(27-10-7-11-30(17-27)40-3)28-13-12-26-14-15-34(22-29(26)16-28)31(37)18-32(38)39/h4-13,16-17,23-24,33H,14-15,18-22H2,1-3H3,(H,38,39)/t23-,24+,33+/m1/s1
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n/an/a 15.8n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422806
PNG
(CHEMBL201816)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(F)c2)c2ccc3CCN(Cc3c2)C(=O)CC(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H36FN3O3/c1-22-19-36(23(2)18-35(22)20-24-7-4-3-5-8-24)32(26-9-6-10-29(33)16-26)27-12-11-25-13-14-34(21-28(25)15-27)30(37)17-31(38)39/h3-12,15-16,22-23,32H,13-14,17-21H2,1-2H3,(H,38,39)/t22-,23+,32+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422799
PNG
(CHEMBL380526)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(CC(O)=O)Cc2c1
Show InChI InChI=1S/C31H37N3O3/c1-22-17-34(23(2)16-33(22)18-24-8-5-4-6-9-24)31(25-10-7-11-29(15-25)37-3)26-12-13-27-19-32(21-30(35)36)20-28(27)14-26/h4-15,22-23,31H,16-21H2,1-3H3,(H,35,36)/t22-,23+,31+/m1/s1
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n/an/a 25.1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422805
PNG
(CHEMBL370558)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CCC(O)=O)Cc3c2)c2cccc(F)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H36FN3O2/c1-22-18-35(23(2)17-34(22)19-24-7-4-3-5-8-24)31(25-9-6-10-29(32)16-25)26-11-12-27-20-33(14-13-30(36)37)21-28(27)15-26/h3-12,15-16,22-23,31H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 25.1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422793
PNG
(CHEMBL203903)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2ccccc2C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-9-4-3-5-10-26)34(27-11-8-12-31(40)18-27)28-15-16-29-22-38(23-30(29)17-28)35(41)32-13-6-7-14-33(32)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 50n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422807
PNG
(CHEMBL204704)
Show SMILES C[C@@H]1CN([C@@H](c2ccccc2)c2ccc3CN(CCC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O2/c1-23-19-34(24(2)18-33(23)20-25-9-5-3-6-10-25)31(26-11-7-4-8-12-26)27-13-14-28-21-32(16-15-30(35)36)22-29(28)17-27/h3-14,17,23-24,31H,15-16,18-22H2,1-2H3,(H,35,36)/t23-,24+,31+/m1/s1
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n/an/a 63.1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422794
PNG
(CHEMBL202557)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(F)c2)c2ccc3CCN(CCC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H38FN3O2/c1-23-20-36(24(2)19-35(23)21-25-7-4-3-5-8-25)32(27-9-6-10-30(33)18-27)28-12-11-26-13-15-34(16-14-31(37)38)22-29(26)17-28/h3-12,17-18,23-24,32H,13-16,19-22H2,1-2H3,(H,37,38)/t23-,24+,32+/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422801
PNG
(CHEMBL382761)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422798
PNG
(CHEMBL201678)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C30H35N3O3/c1-21-16-33(22(2)15-32(21)17-23-7-4-3-5-8-23)30(24-9-6-10-28(34)14-24)25-11-12-26-18-31(20-29(35)36)19-27(26)13-25/h3-14,21-22,30,34H,15-20H2,1-2H3,(H,35,36)/t21-,22+,30+/m1/s1
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n/an/a 126n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422795
PNG
(CHEMBL202585)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)CC(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H37N3O4/c1-22-19-35(23(2)18-34(22)20-24-7-4-3-5-8-24)32(26-9-6-10-29(36)16-26)27-12-11-25-13-14-33(21-28(25)15-27)30(37)17-31(38)39/h3-12,15-16,22-23,32,36H,13-14,17-21H2,1-2H3,(H,38,39)/t22-,23+,32+/m1/s1
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n/an/a 200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422811
PNG
(CHEMBL204716)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)C(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H35N3O4/c1-21-18-34(22(2)17-33(21)19-23-7-4-3-5-8-23)29(25-9-6-10-28(35)16-25)26-12-11-24-13-14-32(20-27(24)15-26)30(36)31(37)38/h3-12,15-16,21-22,29,35H,13-14,17-20H2,1-2H3,(H,37,38)/t21-,22+,29+/m1/s1
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n/an/a 200n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422804
PNG
(CHEMBL202578)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(26-9-6-10-29(35)16-26)27-12-11-25-13-14-32(21-30(36)37)20-28(25)15-27/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 316n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422810
PNG
(CHEMBL381534)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(Cc2c1)C(=O)c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C37H39N3O4/c1-25-21-40(26(2)20-38(25)22-27-8-5-4-6-9-27)35(30-10-7-11-34(19-30)44-3)31-16-17-32-23-39(24-33(32)18-31)36(41)28-12-14-29(15-13-28)37(42)43/h4-19,25-26,35H,20-24H2,1-3H3,(H,42,43)/t25-,26+,35+/m1/s1
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n/an/a 398n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422811
PNG
(CHEMBL204716)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)C(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H35N3O4/c1-21-18-34(22(2)17-33(21)19-23-7-4-3-5-8-23)29(25-9-6-10-28(35)16-25)26-12-11-24-13-14-32(20-27(24)15-26)30(36)31(37)38/h3-12,15-16,21-22,29,35H,13-14,17-20H2,1-2H3,(H,37,38)/t21-,22+,29+/m1/s1
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n/an/a 398n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422795
PNG
(CHEMBL202585)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(Cc3c2)C(=O)CC(O)=O)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H37N3O4/c1-22-19-35(23(2)18-34(22)20-24-7-4-3-5-8-24)32(26-9-6-10-29(36)16-26)27-12-11-25-13-14-33(21-28(25)15-27)30(37)17-31(38)39/h3-12,15-16,22-23,32,36H,13-14,17-21H2,1-2H3,(H,38,39)/t22-,23+,32+/m1/s1
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n/an/a 398n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50422812
PNG
(CHEMBL382283)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(26-10-7-11-30(17-26)38-3)27-12-13-28-21-33(15-14-31(36)37)22-29(28)16-27/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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n/an/a 630n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422796
PNG
(CHEMBL201205)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CCC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(25-9-6-10-29(35)16-25)26-11-12-27-20-32(14-13-30(36)37)21-28(27)15-26/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 631n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422791
PNG
(CHEMBL204480)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CCC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H39N3O3/c1-23-20-35(24(2)19-34(23)21-25-7-4-3-5-8-25)32(27-9-6-10-30(36)18-27)28-12-11-26-13-15-33(16-14-31(37)38)22-29(26)17-28/h3-12,17-18,23-24,32,36H,13-16,19-22H2,1-2H3,(H,37,38)/t23-,24+,32+/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422804
PNG
(CHEMBL202578)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(26-9-6-10-29(35)16-26)27-12-11-25-13-14-32(21-30(36)37)20-28(25)15-27/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422797
PNG
(CHEMBL380749)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C33H41N3O3/c1-24-21-36(25(2)20-35(24)22-26-8-5-4-6-9-26)33(28-10-7-11-31(19-28)39-3)29-13-12-27-14-16-34(17-15-32(37)38)23-30(27)18-29/h4-13,18-19,24-25,33H,14-17,20-23H2,1-3H3,(H,37,38)/t24-,25+,33+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422801
PNG
(CHEMBL382761)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422798
PNG
(CHEMBL201678)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C30H35N3O3/c1-21-16-33(22(2)15-32(21)17-23-7-4-3-5-8-23)30(24-9-6-10-28(34)14-24)25-11-12-26-18-31(20-29(35)36)19-27(26)13-25/h3-14,21-22,30,34H,15-20H2,1-2H3,(H,35,36)/t21-,22+,30+/m1/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422792
PNG
(CHEMBL202478)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(27-10-7-11-30(17-27)38-3)28-13-12-26-14-15-33(22-31(36)37)21-29(26)16-28/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422810
PNG
(CHEMBL381534)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(Cc2c1)C(=O)c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C37H39N3O4/c1-25-21-40(26(2)20-38(25)22-27-8-5-4-6-9-27)35(30-10-7-11-34(19-30)44-3)31-16-17-32-23-39(24-33(32)18-31)36(41)28-12-14-29(15-13-28)37(42)43/h4-19,25-26,35H,20-24H2,1-3H3,(H,42,43)/t25-,26+,35+/m1/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422793
PNG
(CHEMBL203903)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2ccccc2C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-9-4-3-5-10-26)34(27-11-8-12-31(40)18-27)28-15-16-29-22-38(23-30(29)17-28)35(41)32-13-6-7-14-33(32)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1
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n/an/a 3.98E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422792
PNG
(CHEMBL202478)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(27-10-7-11-30(17-27)38-3)28-13-12-26-14-15-33(22-31(36)37)21-29(26)16-28/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422791
PNG
(CHEMBL204480)
Show SMILES C[C@@H]1CN([C@@H](c2cccc(O)c2)c2ccc3CCN(CCC(O)=O)Cc3c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C32H39N3O3/c1-23-20-35(24(2)19-34(23)21-25-7-4-3-5-8-25)32(27-9-6-10-30(36)18-27)28-12-11-26-13-15-33(16-14-31(37)38)22-29(26)17-28/h3-12,17-18,23-24,32,36H,13-16,19-22H2,1-2H3,(H,37,38)/t23-,24+,32+/m1/s1
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n/an/a 5.01E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422796
PNG
(CHEMBL201205)
Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(CCC(O)=O)Cc3c2)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1
Show InChI InChI=1S/C31H37N3O3/c1-22-18-34(23(2)17-33(22)19-24-7-4-3-5-8-24)31(25-9-6-10-29(35)16-25)26-11-12-27-20-32(14-13-30(36)37)21-28(27)15-26/h3-12,15-16,22-23,31,35H,13-14,17-21H2,1-2H3,(H,36,37)/t22-,23+,31+/m1/s1
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n/an/a 7.94E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422797
PNG
(CHEMBL380749)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CCN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C33H41N3O3/c1-24-21-36(25(2)20-35(24)22-26-8-5-4-6-9-26)33(28-10-7-11-31(19-28)39-3)29-13-12-27-14-16-34(17-15-32(37)38)23-30(27)18-29/h4-13,18-19,24-25,33H,14-17,20-23H2,1-3H3,(H,37,38)/t24-,25+,33+/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50422812
PNG
(CHEMBL382283)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(26-10-7-11-30(17-26)38-3)27-12-13-28-21-33(15-14-31(36)37)22-29(28)16-27/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50422812
PNG
(CHEMBL382283)
Show SMILES COc1cccc(c1)[C@H](N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C)c1ccc2CN(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C32H39N3O3/c1-23-19-35(24(2)18-34(23)20-25-8-5-4-6-9-25)32(26-10-7-11-30(17-26)38-3)27-12-13-28-21-33(15-14-31(36)37)22-29(28)16-27/h4-13,16-17,23-24,32H,14-15,18-22H2,1-3H3,(H,36,37)/t23-,24+,32+/m1/s1
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Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig


Bioorg Med Chem Lett 16: 905-10 (2006)


Article DOI: 10.1016/j.bmcl.2005.10.102
BindingDB Entry DOI: 10.7270/Q2930VG2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%