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PubMed code 18788723

Compile data set for download or QSAR
Found 61 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))
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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0.320n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252953
PNG
(CHEMBL494479 | N,N-Diethyl-4-(6-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccc(O)cc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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0.430n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252954
PNG
(ADL-5859 | CHEMBL494480 | N,N-diethyl-4-(5-hydroxy...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cccc(O)c12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-10-8-17(9-11-18)19-16-24(12-14-25-15-13-24)29-21-7-5-6-20(27)22(19)21/h5-11,16,25,27H,3-4,12-15H2,1-2H3
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0.840n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
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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1.20n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252952
PNG
(CHEMBL495094 | N,N-Diethyl-4-(7-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cc(O)ccc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-15-19(27)9-10-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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1.5n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252876
PNG
(CHEMBL494462 | N,N-Diethyl-4-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)19-11-9-18(10-12-19)21-17-24(13-15-25-16-14-24)28-22-8-6-5-7-20(21)22/h5-12,17,25H,3-4,13-16H2,1-2H3
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1.80n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252925
PNG
(CHEMBL494275 | N,N-Diethyl-4-(1'-methylspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(C)CC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C25H30N2O2/c1-4-27(5-2)24(28)20-12-10-19(11-13-20)22-18-25(14-16-26(3)17-15-25)29-23-9-7-6-8-21(22)23/h6-13,18H,4-5,14-17H2,1-3H3
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3.5n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252874
PNG
(CHEMBL494265 | Methyl 4-(spiro[chromene-2,4'-piper...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C21H21NO3/c1-24-20(23)16-8-6-15(7-9-16)18-14-21(10-12-22-13-11-21)25-19-5-3-2-4-17(18)19/h2-9,14,22H,10-13H2,1H3
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9.30n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252875
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzoic ac...)
Show SMILES OC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:10|
Show InChI InChI=1S/C20H19NO3/c22-19(23)15-7-5-14(6-8-15)17-13-20(9-11-21-12-10-20)24-18-4-2-1-3-16(17)18/h1-8,13,21H,9-12H2,(H,22,23)
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11n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252835
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzonitri...)
Show SMILES N#Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H18N2O/c21-14-15-5-7-16(8-6-15)18-13-20(9-11-22-12-10-20)23-19-4-2-1-3-17(18)19/h1-8,13,22H,9-12H2
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18n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252833
PNG
(4-(4-Methoxyphenyl)spiro[chromene-2,4'-piperidine]...)
Show SMILES COc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H21NO2/c1-22-16-8-6-15(7-9-16)18-14-20(10-12-21-13-11-20)23-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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58n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252834
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)phenol | C...)
Show SMILES Oc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2
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59n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252926
PNG
(CHEMBL494472 | N,N-Diethyl-4-(1'-ethylspiro[chrome...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(CC)CC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C26H32N2O2/c1-4-27-17-15-26(16-18-27)19-23(22-9-7-8-10-24(22)30-26)20-11-13-21(14-12-20)25(29)28(5-2)6-3/h7-14,19H,4-6,15-18H2,1-3H3
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68n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252830
PNG
(4-Phenylspiro[chromene-2,4'-piperidine] | CHEMBL49...)
Show SMILES C1CC2(CCN1)Oc1ccccc1C(=C2)c1ccccc1 |c:15|
Show InChI InChI=1S/C19H19NO/c1-2-6-15(7-3-1)17-14-19(10-12-20-13-11-19)21-18-9-5-4-8-16(17)18/h1-9,14,20H,10-13H2
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71n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252831
PNG
(4-(p-Tolyl)spiro[chromene-2,4'-piperidine] | CHEMB...)
Show SMILES Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C20H21NO/c1-15-6-8-16(9-7-15)18-14-20(10-12-21-13-11-20)22-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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72n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
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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130n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells at 10 uM


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252832
PNG
(4-(4-(Trifluoromethyl)phenyl)spiro [chromene-2,4'-...)
Show SMILES FC(F)(F)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C20H18F3NO/c21-20(22,23)15-7-5-14(6-8-15)17-13-19(9-11-24-12-10-19)25-18-4-2-1-3-16(17)18/h1-8,13,24H,9-12H2
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150n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252799
PNG
(4-phenyl-3,4-dihydrospiro[chromene-2,4'-piperidine...)
Show SMILES C1CC2(CCN1)CC(c1ccccc1)c1ccccc1O2
Show InChI InChI=1S/C19H21NO/c1-2-6-15(7-3-1)17-14-19(10-12-20-13-11-19)21-18-9-5-4-8-16(17)18/h1-9,17,20H,10-14H2
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160n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
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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260n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human mu opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252877
PNG
(CHEMBL523204 | N,N-Diethyl-3-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1cccc(c1)C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)19-9-7-8-18(16-19)21-17-24(12-14-25-15-13-24)28-22-11-6-5-10-20(21)22/h5-11,16-17,25H,3-4,12-15H2,1-2H3
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330n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252927
PNG
(CHEMBL523507 | N,N-Diethyl-4-(8-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2c(O)cccc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-10-8-17(9-11-18)20-16-24(12-14-25-15-13-24)29-22-19(20)6-5-7-21(22)27/h5-11,16,25,27H,3-4,12-15H2,1-2H3
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360n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252878
PNG
(CHEMBL493454 | N,N-Diethyl-2-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1ccccc1C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)20-11-6-5-9-18(20)21-17-24(13-15-25-16-14-24)28-22-12-8-7-10-19(21)22/h5-12,17,25H,3-4,13-16H2,1-2H3
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480n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252798
PNG
(1'-{[(4-chlorophenyl)methane]sulfonyl}-4-phenyl-3,...)
Show SMILES Clc1ccc(CS(=O)(=O)N2CCC3(CC2)CC(c2ccccc2)c2ccccc2O3)cc1
Show InChI InChI=1S/C26H26ClNO3S/c27-22-12-10-20(11-13-22)19-32(29,30)28-16-14-26(15-17-28)18-24(21-6-2-1-3-7-21)23-8-4-5-9-25(23)31-26/h1-13,24H,14-19H2
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500n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50252874
PNG
(CHEMBL494265 | Methyl 4-(spiro[chromene-2,4'-piper...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C21H21NO3/c1-24-20(23)16-8-6-15(7-9-16)18-14-21(10-12-22-13-11-21)25-19-5-3-2-4-17(18)19/h2-9,14,22H,10-13H2,1H3
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520n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50252953
PNG
(CHEMBL494479 | N,N-Diethyl-4-(6-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccc(O)cc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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830n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252924
PNG
(4-(1'-Acetylspiro[chromene-2,4'-piperidine]-4-yl)-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(CC2)C(C)=O)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C26H30N2O3/c1-4-27(5-2)25(30)21-12-10-20(11-13-21)23-18-26(14-16-28(17-15-26)19(3)29)31-24-9-7-6-8-22(23)24/h6-13,18H,4-5,14-17H2,1-3H3
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1.30E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50252832
PNG
(4-(4-(Trifluoromethyl)phenyl)spiro [chromene-2,4'-...)
Show SMILES FC(F)(F)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C20H18F3NO/c21-20(22,23)15-7-5-14(6-8-15)17-13-19(9-11-24-12-10-19)25-18-4-2-1-3-16(17)18/h1-8,13,24H,9-12H2
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2.00E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
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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3.40E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50252830
PNG
(4-Phenylspiro[chromene-2,4'-piperidine] | CHEMBL49...)
Show SMILES C1CC2(CCN1)Oc1ccccc1C(=C2)c1ccccc1 |c:15|
Show InChI InChI=1S/C19H19NO/c1-2-6-15(7-3-1)17-14-19(10-12-20-13-11-19)21-18-9-5-4-8-16(17)18/h1-9,14,20H,10-13H2
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3.40E+3n/an/an/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor in CHO cells


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252835
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzonitri...)
Show SMILES N#Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H18N2O/c21-14-15-5-7-16(8-6-15)18-13-20(9-11-22-12-10-20)23-19-4-2-1-3-17(18)19/h1-8,13,22H,9-12H2
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n/an/a<100n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252877
PNG
(CHEMBL523204 | N,N-Diethyl-3-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1cccc(c1)C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)19-9-7-8-18(16-19)21-17-24(12-14-25-15-13-24)28-22-11-6-5-10-20(21)22/h5-11,16-17,25H,3-4,12-15H2,1-2H3
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n/an/a 303n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252832
PNG
(4-(4-(Trifluoromethyl)phenyl)spiro [chromene-2,4'-...)
Show SMILES FC(F)(F)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C20H18F3NO/c21-20(22,23)15-7-5-14(6-8-15)17-13-19(9-11-24-12-10-19)25-18-4-2-1-3-16(17)18/h1-8,13,24H,9-12H2
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n/an/a 379n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252831
PNG
(4-(p-Tolyl)spiro[chromene-2,4'-piperidine] | CHEMB...)
Show SMILES Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C20H21NO/c1-15-6-8-16(9-7-15)18-14-20(10-12-21-13-11-20)22-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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n/an/a 462n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252833
PNG
(4-(4-Methoxyphenyl)spiro[chromene-2,4'-piperidine]...)
Show SMILES COc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H21NO2/c1-22-16-8-6-15(7-9-16)18-14-20(10-12-21-13-11-20)23-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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n/an/a 585n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252834
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)phenol | C...)
Show SMILES Oc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2
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n/an/a 643n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252874
PNG
(CHEMBL494265 | Methyl 4-(spiro[chromene-2,4'-piper...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C21H21NO3/c1-24-20(23)16-8-6-15(7-9-16)18-14-21(10-12-22-13-11-21)25-19-5-3-2-4-17(18)19/h2-9,14,22H,10-13H2,1H3
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n/an/a 663n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252830
PNG
(4-Phenylspiro[chromene-2,4'-piperidine] | CHEMBL49...)
Show SMILES C1CC2(CCN1)Oc1ccccc1C(=C2)c1ccccc1 |c:15|
Show InChI InChI=1S/C19H19NO/c1-2-6-15(7-3-1)17-14-19(10-12-20-13-11-19)21-18-9-5-4-8-16(17)18/h1-9,14,20H,10-13H2
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n/an/a 680n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252925
PNG
(CHEMBL494275 | N,N-Diethyl-4-(1'-methylspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(C)CC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C25H30N2O2/c1-4-27(5-2)24(28)20-12-10-19(11-13-20)22-18-25(14-16-26(3)17-15-25)29-23-9-7-6-8-21(22)23/h6-13,18H,4-5,14-17H2,1-3H3
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n/an/a 766n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252926
PNG
(CHEMBL494472 | N,N-Diethyl-4-(1'-ethylspiro[chrome...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(CC)CC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C26H32N2O2/c1-4-27-17-15-26(16-18-27)19-23(22-9-7-8-10-24(22)30-26)20-11-13-21(14-12-20)25(29)28(5-2)6-3/h7-14,19H,4-6,15-18H2,1-3H3
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n/an/a 1.81E+3n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252878
PNG
(CHEMBL493454 | N,N-Diethyl-2-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1ccccc1C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)20-11-6-5-9-18(20)21-17-24(13-15-25-16-14-24)28-22-12-8-7-10-19(21)22/h5-12,17,25H,3-4,13-16H2,1-2H3
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n/an/a 6.45E+3n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252876
PNG
(CHEMBL494462 | N,N-Diethyl-4-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)19-11-9-18(10-12-19)21-17-24(13-15-25-16-14-24)28-22-8-6-5-7-20(21)22/h5-12,17,25H,3-4,13-16H2,1-2H3
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n/an/a 7.90E+3n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252927
PNG
(CHEMBL523507 | N,N-Diethyl-4-(8-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2c(O)cccc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-10-8-17(9-11-18)20-16-24(12-14-25-15-13-24)29-22-19(20)6-5-7-21(22)27/h5-11,16,25,27H,3-4,12-15H2,1-2H3
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n/an/a 1.83E+4n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252953
PNG
(CHEMBL494479 | N,N-Diethyl-4-(6-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccc(O)cc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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n/an/a 1.98E+4n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252924
PNG
(4-(1'-Acetylspiro[chromene-2,4'-piperidine]-4-yl)-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(CC2)C(C)=O)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C26H30N2O3/c1-4-27(5-2)25(30)21-12-10-20(11-13-21)23-18-26(14-16-28(17-15-26)19(3)29)31-24-9-7-6-8-22(23)24/h6-13,18H,4-5,14-17H2,1-3H3
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n/an/a 4.74E+4n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252952
PNG
(CHEMBL495094 | N,N-Diethyl-4-(7-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cc(O)ccc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-15-19(27)9-10-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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n/an/a 6.00E+4n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252954
PNG
(ADL-5859 | CHEMBL494480 | N,N-diethyl-4-(5-hydroxy...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cccc(O)c12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-10-8-17(9-11-18)19-16-24(12-14-25-15-13-24)29-21-7-5-6-20(27)22(19)21/h5-11,16,25,27H,3-4,12-15H2,1-2H3
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n/an/a 7.80E+4n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50252875
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzoic ac...)
Show SMILES OC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:10|
Show InChI InChI=1S/C20H19NO3/c22-19(23)15-7-5-14(6-8-15)17-13-20(9-11-21-12-10-20)24-18-4-2-1-3-16(17)18/h1-8,13,21H,9-12H2,(H,22,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Inhibition of human ERG channel in HEK293 cells by voltage-clamp method


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252925
PNG
(CHEMBL494275 | N,N-Diethyl-4-(1'-methylspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCN(C)CC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C25H30N2O2/c1-4-27(5-2)24(28)20-12-10-19(11-13-20)22-18-25(14-16-26(3)17-15-25)29-23-9-7-6-8-21(22)23/h6-13,18H,4-5,14-17H2,1-3H3
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n/an/an/an/a 89n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
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/an/an/a 0.400n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252834
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)phenol | C...)
Show SMILES Oc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2
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n/an/an/an/a 220n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252835
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzonitri...)
Show SMILES N#Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H18N2O/c21-14-15-5-7-16(8-6-15)18-13-20(9-11-22-12-10-20)23-19-4-2-1-3-17(18)19/h1-8,13,22H,9-12H2
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n/an/an/an/a 200n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
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/an/an/a 10n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252833
PNG
(4-(4-Methoxyphenyl)spiro[chromene-2,4'-piperidine]...)
Show SMILES COc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:9|
Show InChI InChI=1S/C20H21NO2/c1-22-16-8-6-15(7-9-16)18-14-20(10-12-21-13-11-20)23-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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n/an/an/an/a 190n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252876
PNG
(CHEMBL494462 | N,N-Diethyl-4-(spiro[chromene-2,4'-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:14|
Show InChI InChI=1S/C24H28N2O2/c1-3-26(4-2)23(27)19-11-9-18(10-12-19)21-17-24(13-15-25-16-14-24)28-22-8-6-5-7-20(21)22/h5-12,17,25H,3-4,13-16H2,1-2H3
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n/an/an/an/a 19n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252952
PNG
(CHEMBL495094 | N,N-Diethyl-4-(7-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cc(O)ccc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-15-19(27)9-10-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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n/an/an/an/a 140n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252953
PNG
(CHEMBL494479 | N,N-Diethyl-4-(6-hydroxyspiro[chrom...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccc(O)cc12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22/h5-10,15-16,25,27H,3-4,11-14H2,1-2H3
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n/an/an/an/a 1.40n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252831
PNG
(4-(p-Tolyl)spiro[chromene-2,4'-piperidine] | CHEMB...)
Show SMILES Cc1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:8|
Show InChI InChI=1S/C20H21NO/c1-15-6-8-16(9-7-15)18-14-20(10-12-21-13-11-20)22-19-5-3-2-4-17(18)19/h2-9,14,21H,10-13H2,1H3
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n/an/an/an/a 810n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252875
PNG
(4-(Spiro[chromene-2,4'-piperidine]-4-yl)benzoic ac...)
Show SMILES OC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:10|
Show InChI InChI=1S/C20H19NO3/c22-19(23)15-7-5-14(6-8-15)17-13-20(9-11-21-12-10-20)24-18-4-2-1-3-16(17)18/h1-8,13,21H,9-12H2,(H,22,23)
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n/an/an/an/a 220n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252954
PNG
(ADL-5859 | CHEMBL494480 | N,N-diethyl-4-(5-hydroxy...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2cccc(O)c12 |t:14|
Show InChI InChI=1S/C24H28N2O3/c1-3-26(4-2)23(28)18-10-8-17(9-11-18)19-16-24(12-14-25-15-13-24)29-21-7-5-6-20(27)22(19)21/h5-11,16,25,27H,3-4,12-15H2,1-2H3
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n/an/an/an/a 20n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252874
PNG
(CHEMBL494265 | Methyl 4-(spiro[chromene-2,4'-piper...)
Show SMILES COC(=O)c1ccc(cc1)C1=CC2(CCNCC2)Oc2ccccc12 |t:11|
Show InChI InChI=1S/C21H21NO3/c1-24-20(23)16-8-6-15(7-9-16)18-14-21(10-12-22-13-11-21)25-19-5-3-2-4-17(18)19/h2-9,14,22H,10-13H2,1H3
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n/an/an/an/a 81n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50252830
PNG
(4-Phenylspiro[chromene-2,4'-piperidine] | CHEMBL49...)
Show SMILES C1CC2(CCN1)Oc1ccccc1C(=C2)c1ccccc1 |c:15|
Show InChI InChI=1S/C19H19NO/c1-2-6-15(7-3-1)17-14-19(10-12-20-13-11-19)21-18-9-5-4-8-16(17)18/h1-9,14,20H,10-13H2
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n/an/an/an/a 380n/an/an/an/a



Adolor Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor in CHO cells assessed as stimulation of [35S]GTPgammaS binding


J Med Chem 51: 5893-6 (2008)


Article DOI: 10.1021/jm8008986
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%