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Compile Data Set for Download or QSAR

Found 35 hits Enz. Inhib. hit(s) with all data for entry = 50029656   
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))
BDBM50286589
PNG
((S)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20+/m1/s1
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0.25n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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Article
3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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15n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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27n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286584
PNG
((S)-5-{(S)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20-/m0/s1
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32n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286586
PNG
((R)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m1/s1
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35n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286589
PNG
((S)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20+/m1/s1
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63n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286587
PNG
((R)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20-/m1/s1
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87n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286580
PNG
((R)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m1/s1
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100n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286585
PNG
((S)-5-{(R)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m0/s1
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145n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286591
PNG
((R)-5-{(S)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20+/m1/s1
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198n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286587
PNG
((R)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20-/m1/s1
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260n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286589
PNG
((S)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20+/m1/s1
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265n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286583
PNG
((R)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m0/s1
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270n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286588
PNG
((S)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20+/m0/s1
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340n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286581
PNG
((S)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m1/s1
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390n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286581
PNG
((S)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m1/s1
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550n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286587
PNG
((R)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20-/m1/s1
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1.78E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286580
PNG
((R)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m1/s1
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1.85E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286582
PNG
((S)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m0/s1
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2.25E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286588
PNG
((S)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20+/m0/s1
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3.65E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286586
PNG
((R)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m1/s1
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4.85E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286583
PNG
((R)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286585
PNG
((S)-5-{(R)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286591
PNG
((R)-5-{(S)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20+/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286581
PNG
((S)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286586
PNG
((R)-5-{(R)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286584
PNG
((S)-5-{(S)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286580
PNG
((R)-5-{(S)-2-[Bis-((R)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286583
PNG
((R)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286588
PNG
((S)-5-{(R)-2-[((R)-sec-Butyl)-((S)-sec-butyl)-amin...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16+,19-,20+/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286582
PNG
((S)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286590
PNG
((R)-5-{(R)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19+,20+/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-dihydromorphine (1 nM) binding to mu opioid receptor of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286582
PNG
((S)-5-{(S)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 9 (2nM) binding to Opioid receptor kappa 1 of rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50286585
PNG
((S)-5-{(R)-2-[Bis-((S)-sec-butyl)-amino]-1-hydroxy...)
Show SMILES CC[C@H](C)N(C[C@@H](O)[C@@H]1CCC(=O)N1Cc1ccccc1Cl)[C@@H](C)CC
Show InChI InChI=1S/C21H33ClN2O2/c1-5-15(3)23(16(4)6-2)14-20(25)19-11-12-21(26)24(19)13-17-9-7-8-10-18(17)22/h7-10,15-16,19-20,25H,5-6,11-14H2,1-4H3/t15-,16-,19-,20+/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-[D-Pen2, D-Pen5]-enkephalin (2 nM) to Opioid receptor delta 1 of male Sprague-Dawley rat brain homogenate


Bioorg Med Chem Lett 5: 589-592 (1995)


Article DOI: 10.1016/0960-894X(95)00077-7
BindingDB Entry DOI: 10.7270/Q2M908PK
More data for this
Ligand-Target Pair