Found 66 hits Enz. Inhib. hit(s) with all data for entry = 50033583 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM21398
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2 | PDB
Reactome pathway
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PC sid
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| DrugBank
Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM21398
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347634
(CHEMBL1803028)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C54H72N10O8/c1-65-49-15-7-5-13-47(49)61-25-21-59(22-26-61)39-43-17-19-51(53(37-43)67-3)71-31-9-11-45-41-63(57-55-45)29-33-69-35-36-70-34-30-64-42-46(56-58-64)12-10-32-72-52-20-18-44(38-54(52)68-4)40-60-23-27-62(28-24-60)48-14-6-8-16-50(48)66-2/h5-8,13-20,37-38,41-42H,9-12,21-36,39-40H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347633
(CHEMBL1803027)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCc3cn(CCOCCOCCn4cc(COc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C50H64N10O8/c1-61-45-11-7-5-9-43(45)57-21-17-55(18-22-57)33-39-13-15-47(49(31-39)63-3)67-37-41-35-59(53-51-41)25-27-65-29-30-66-28-26-60-36-42(52-54-60)38-68-48-16-14-40(32-50(48)64-4)34-56-19-23-58(24-20-56)44-10-6-8-12-46(44)62-2/h5-16,31-32,35-36H,17-30,33-34,37-38H2,1-4H3 | PDB
Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| 3.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347633
(CHEMBL1803027)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCc3cn(CCOCCOCCn4cc(COc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C50H64N10O8/c1-61-45-11-7-5-9-43(45)57-21-17-55(18-22-57)33-39-13-15-47(49(31-39)63-3)67-37-41-35-59(53-51-41)25-27-65-29-30-66-28-26-60-36-42(52-54-60)38-68-48-16-14-40(32-50(48)64-4)34-56-19-23-58(24-20-56)44-10-6-8-12-46(44)62-2/h5-16,31-32,35-36H,17-30,33-34,37-38H2,1-4H3 | PDB
Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347634
(CHEMBL1803028)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C54H72N10O8/c1-65-49-15-7-5-13-47(49)61-25-21-59(22-26-61)39-43-17-19-51(53(37-43)67-3)71-31-9-11-45-41-63(57-55-45)29-33-69-35-36-70-34-30-64-42-46(56-58-64)12-10-32-72-52-20-18-44(38-54(52)68-4)40-60-23-27-62(28-24-60)48-14-6-8-16-50(48)66-2/h5-8,13-20,37-38,41-42H,9-12,21-36,39-40H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347635
(CHEMBL1803029)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C56H76N10O9/c1-67-51-15-7-5-13-49(51)63-25-21-61(22-26-63)41-45-17-19-53(55(39-45)69-3)74-31-9-11-47-43-65(59-57-47)29-33-71-35-37-73-38-36-72-34-30-66-44-48(58-60-66)12-10-32-75-54-20-18-46(40-56(54)70-4)42-62-23-27-64(28-24-62)50-14-6-8-16-52(50)68-2/h5-8,13-20,39-40,43-44H,9-12,21-38,41-42H2,1-4H3 | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347635
(CHEMBL1803029)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C56H76N10O9/c1-67-51-15-7-5-13-49(51)63-25-21-61(22-26-63)41-45-17-19-53(55(39-45)69-3)74-31-9-11-47-43-65(59-57-47)29-33-71-35-37-73-38-36-72-34-30-66-44-48(58-60-66)12-10-32-75-54-20-18-46(40-56(54)70-4)42-62-23-27-64(28-24-62)50-14-6-8-16-52(50)68-2/h5-8,13-20,39-40,43-44H,9-12,21-38,41-42H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM21398
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2 | PDB
UniProtKB/SwissProt
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PC cid
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| Article
PubMed
| 6.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347627
(CHEMBL1803054)Show SMILES COc1cc(CN2CCN(C)CC2)ccc1OCCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C50H72N10O5/c1-55-25-27-56(28-26-55)37-41-19-21-47(49(35-41)62-3)64-33-13-15-43-39-59(53-51-43)23-11-7-5-6-8-12-24-60-40-44(52-54-60)16-14-34-65-48-22-20-42(36-50(48)63-4)38-57-29-31-58(32-30-57)45-17-9-10-18-46(45)61-2/h9-10,17-22,35-36,39-40H,5-8,11-16,23-34,37-38H2,1-4H3 | PDB
Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347632
(CHEMBL1803026)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCCc3cn(CCCCCCCCCCn4cc(CCCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C60H84N10O6/c1-71-55-25-13-11-23-53(55)67-37-33-65(34-38-67)45-49-27-29-57(59(43-49)73-3)75-41-19-15-21-51-47-69(63-61-51)31-17-9-7-5-6-8-10-18-32-70-48-52(62-64-70)22-16-20-42-76-58-30-28-50(44-60(58)74-4)46-66-35-39-68(40-36-66)54-24-12-14-26-56(54)72-2/h11-14,23-30,43-44,47-48H,5-10,15-22,31-42,45-46H2,1-4H3 | PDB
Reactome pathway
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347627
(CHEMBL1803054)Show SMILES COc1cc(CN2CCN(C)CC2)ccc1OCCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C50H72N10O5/c1-55-25-27-56(28-26-55)37-41-19-21-47(49(35-41)62-3)64-33-13-15-43-39-59(53-51-43)23-11-7-5-6-8-12-24-60-40-44(52-54-60)16-14-34-65-48-22-20-42(36-50(48)63-4)38-57-29-31-58(32-30-57)45-17-9-10-18-46(45)61-2/h9-10,17-22,35-36,39-40H,5-8,11-16,23-34,37-38H2,1-4H3 | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347622
(CHEMBL1803049)Show SMILES CCCCn1cc(CCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C28H39N5O3/c1-4-5-14-33-22-24(29-30-33)9-8-19-36-27-13-12-23(20-28(27)35-3)21-31-15-17-32(18-16-31)25-10-6-7-11-26(25)34-2/h6-7,10-13,20,22H,4-5,8-9,14-19,21H2,1-3H3 | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells in presence of 100 mM sodium chloride |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347629
(CHEMBL1803023)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCc1cn(CCCCCCCCn2cc(COc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C52H68N10O6/c1-63-47-17-11-9-15-45(47)59-29-25-57(26-30-59)35-41-19-21-49(51(33-41)65-3)67-39-43-37-61(55-53-43)23-13-7-5-6-8-14-24-62-38-44(54-56-62)40-68-50-22-20-42(34-52(50)66-4)36-58-27-31-60(32-28-58)46-16-10-12-18-48(46)64-2/h9-12,15-22,33-34,37-38H,5-8,13-14,23-32,35-36,39-40H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347625
(CHEMBL1803052)Show SMILES CCOCCn1cc(CCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C28H39N5O4/c1-4-36-19-17-33-22-24(29-30-33)8-7-18-37-27-12-11-23(20-28(27)35-3)21-31-13-15-32(16-14-31)25-9-5-6-10-26(25)34-2/h5-6,9-12,20,22H,4,7-8,13-19,21H2,1-3H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347632
(CHEMBL1803026)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCCc3cn(CCCCCCCCCCn4cc(CCCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C60H84N10O6/c1-71-55-25-13-11-23-53(55)67-37-33-65(34-38-67)45-49-27-29-57(59(43-49)73-3)75-41-19-15-21-51-47-69(63-61-51)31-17-9-7-5-6-8-10-18-32-70-48-52(62-64-70)22-16-20-42-76-58-30-28-50(44-60(58)74-4)46-66-35-39-68(40-36-66)54-24-12-14-26-56(54)72-2/h11-14,23-30,43-44,47-48H,5-10,15-22,31-42,45-46H2,1-4H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347628
(CHEMBL1803055)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)C6CCCCC6)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C55H80N10O5/c1-66-51-22-12-11-21-50(51)63-35-31-61(32-36-63)42-46-24-26-53(55(40-46)68-3)70-38-16-18-48-44-65(59-57-48)28-14-7-5-4-6-13-27-64-43-47(56-58-64)17-15-37-69-52-25-23-45(39-54(52)67-2)41-60-29-33-62(34-30-60)49-19-9-8-10-20-49/h11-12,21-26,39-40,43-44,49H,4-10,13-20,27-38,41-42H2,1-3H3 | PDB
Reactome pathway
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PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347631
(CHEMBL1803025)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C58H80N10O6/c1-69-53-23-13-11-21-51(53)65-35-31-63(32-36-65)43-47-25-27-55(57(41-47)71-3)73-39-17-19-49-45-67(61-59-49)29-15-9-7-5-6-8-10-16-30-68-46-50(60-62-68)20-18-40-74-56-28-26-48(42-58(56)72-4)44-64-33-37-66(38-34-64)52-22-12-14-24-54(52)70-2/h11-14,21-28,41-42,45-46H,5-10,15-20,29-40,43-44H2,1-4H3 | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347625
(CHEMBL1803052)Show SMILES CCOCCn1cc(CCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C28H39N5O4/c1-4-36-19-17-33-22-24(29-30-33)8-7-18-37-27-12-11-23(20-28(27)35-3)21-31-13-15-32(16-14-31)25-9-5-6-10-26(25)34-2/h5-6,9-12,20,22H,4,7-8,13-19,21H2,1-3H3 | PDB
Reactome pathway
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347628
(CHEMBL1803055)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)C6CCCCC6)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C55H80N10O5/c1-66-51-22-12-11-21-50(51)63-35-31-61(32-36-63)42-46-24-26-53(55(40-46)68-3)70-38-16-18-48-44-65(59-57-48)28-14-7-5-4-6-13-27-64-43-47(56-58-64)17-15-37-69-52-25-23-45(39-54(52)67-2)41-60-29-33-62(34-30-60)49-19-9-8-10-20-49/h11-12,21-26,39-40,43-44,49H,4-10,13-20,27-38,41-42H2,1-3H3 | PDB
Reactome pathway
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347630
(CHEMBL1803024)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C56H76N10O6/c1-67-51-21-11-9-19-49(51)63-33-29-61(30-34-63)41-45-23-25-53(55(39-45)69-3)71-37-15-17-47-43-65(59-57-47)27-13-7-5-6-8-14-28-66-44-48(58-60-66)18-16-38-72-54-26-24-46(40-56(54)70-4)42-62-31-35-64(36-32-62)50-20-10-12-22-52(50)68-2/h9-12,19-26,39-40,43-44H,5-8,13-18,27-38,41-42H2,1-4H3 | PDB
Reactome pathway
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347631
(CHEMBL1803025)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C58H80N10O6/c1-69-53-23-13-11-21-51(53)65-35-31-63(32-36-65)43-47-25-27-55(57(41-47)71-3)73-39-17-19-49-45-67(61-59-49)29-15-9-7-5-6-8-10-16-30-68-46-50(60-62-68)20-18-40-74-56-28-26-48(42-58(56)72-4)44-64-33-37-66(38-34-64)52-22-12-14-24-54(52)70-2/h11-14,21-28,41-42,45-46H,5-10,15-20,29-40,43-44H2,1-4H3 | PDB
Reactome pathway
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| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347629
(CHEMBL1803023)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCc1cn(CCCCCCCCn2cc(COc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C52H68N10O6/c1-63-47-17-11-9-15-45(47)59-29-25-57(26-30-59)35-41-19-21-49(51(33-41)65-3)67-39-43-37-61(55-53-43)23-13-7-5-6-8-14-24-62-38-44(54-56-62)40-68-50-22-20-42(34-52(50)66-4)36-58-27-31-60(32-28-58)46-16-10-12-18-48(46)64-2/h9-12,15-22,33-34,37-38H,5-8,13-14,23-32,35-36,39-40H2,1-4H3 | PDB
Reactome pathway
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| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347629
(CHEMBL1803023)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCc1cn(CCCCCCCCn2cc(COc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C52H68N10O6/c1-63-47-17-11-9-15-45(47)59-29-25-57(26-30-59)35-41-19-21-49(51(33-41)65-3)67-39-43-37-61(55-53-43)23-13-7-5-6-8-14-24-62-38-44(54-56-62)40-68-50-22-20-42(34-52(50)66-4)36-58-27-31-60(32-28-58)46-16-10-12-18-48(46)64-2/h9-12,15-22,33-34,37-38H,5-8,13-14,23-32,35-36,39-40H2,1-4H3 | PDB
UniProtKB/SwissProt
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| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347626
(CHEMBL1803053)Show SMILES CCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C37H54N8O3/c1-4-14-32-29-44(40-38-32)20-11-7-5-6-8-12-21-45-30-33(39-41-45)15-13-26-48-36-19-18-31(27-37(36)47-3)28-42-22-24-43(25-23-42)34-16-9-10-17-35(34)46-2/h9-10,16-19,27,29-30H,4-8,11-15,20-26,28H2,1-3H3 | PDB
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| 32 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347630
(CHEMBL1803024)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C56H76N10O6/c1-67-51-21-11-9-19-49(51)63-33-29-61(30-34-63)41-45-23-25-53(55(39-45)69-3)71-37-15-17-47-43-65(59-57-47)27-13-7-5-6-8-14-28-66-44-48(58-60-66)18-16-38-72-54-26-24-46(40-56(54)70-4)42-62-31-35-64(36-32-62)50-20-10-12-22-52(50)68-2/h9-12,19-26,39-40,43-44H,5-8,13-18,27-38,41-42H2,1-4H3 | PDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells in presence of 100 mM sodium chloride |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347626
(CHEMBL1803053)Show SMILES CCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C37H54N8O3/c1-4-14-32-29-44(40-38-32)20-11-7-5-6-8-12-21-45-30-33(39-41-45)15-13-26-48-36-19-18-31(27-37(36)47-3)28-42-22-24-43(25-23-42)34-16-9-10-17-35(34)46-2/h9-10,16-19,27,29-30H,4-8,11-15,20-26,28H2,1-3H3 | PDB
Reactome pathway
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| 36 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347633
(CHEMBL1803027)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCc3cn(CCOCCOCCn4cc(COc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C50H64N10O8/c1-61-45-11-7-5-9-43(45)57-21-17-55(18-22-57)33-39-13-15-47(49(31-39)63-3)67-37-41-35-59(53-51-41)25-27-65-29-30-66-28-26-60-36-42(52-54-60)38-68-48-16-14-40(32-50(48)64-4)34-56-19-23-58(24-20-56)44-10-6-8-12-46(44)62-2/h5-16,31-32,35-36H,17-30,33-34,37-38H2,1-4H3 | PDB
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| 36 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347630
(CHEMBL1803024)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C56H76N10O6/c1-67-51-21-11-9-19-49(51)63-33-29-61(30-34-63)41-45-23-25-53(55(39-45)69-3)71-37-15-17-47-43-65(59-57-47)27-13-7-5-6-8-14-28-66-44-48(58-60-66)18-16-38-72-54-26-24-46(40-56(54)70-4)42-62-31-35-64(36-32-62)50-20-10-12-22-52(50)68-2/h9-12,19-26,39-40,43-44H,5-8,13-18,27-38,41-42H2,1-4H3 | PDB
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| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347623
(CHEMBL1803050)Show SMILES CCCCn1cc(CCCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C29H41N5O3/c1-4-5-15-34-23-25(30-31-34)10-8-9-20-37-28-14-13-24(21-29(28)36-3)22-32-16-18-33(19-17-32)26-11-6-7-12-27(26)35-2/h6-7,11-14,21,23H,4-5,8-10,15-20,22H2,1-3H3 | PDB
Reactome pathway
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| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347622
(CHEMBL1803049)Show SMILES CCCCn1cc(CCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C28H39N5O3/c1-4-5-14-33-22-24(29-30-33)9-8-19-36-27-13-12-23(20-28(27)35-3)21-31-15-17-32(18-16-31)25-10-6-7-11-26(25)34-2/h6-7,10-13,20,22H,4-5,8-9,14-19,21H2,1-3H3 | PDB
Reactome pathway
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PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347634
(CHEMBL1803028)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C54H72N10O8/c1-65-49-15-7-5-13-47(49)61-25-21-59(22-26-61)39-43-17-19-51(53(37-43)67-3)71-31-9-11-45-41-63(57-55-45)29-33-69-35-36-70-34-30-64-42-46(56-58-64)12-10-32-72-52-20-18-44(38-54(52)68-4)40-60-23-27-62(28-24-60)48-14-6-8-16-50(48)66-2/h5-8,13-20,37-38,41-42H,9-12,21-36,39-40H2,1-4H3 | PDB
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PubMed
| 61 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347621
(CHEMBL1803030)Show SMILES CCCCn1cc(COc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C26H35N5O3/c1-4-5-12-31-19-22(27-28-31)20-34-25-11-10-21(17-26(25)33-3)18-29-13-15-30(16-14-29)23-8-6-7-9-24(23)32-2/h6-11,17,19H,4-5,12-16,18,20H2,1-3H3 | PDB
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PubMed
| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347623
(CHEMBL1803050)Show SMILES CCCCn1cc(CCCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C29H41N5O3/c1-4-5-15-34-23-25(30-31-34)10-8-9-20-37-28-14-13-24(21-29(28)36-3)22-32-16-18-33(19-17-32)26-11-6-7-12-27(26)35-2/h6-7,11-14,21,23H,4-5,8-10,15-20,22H2,1-3H3 | PDB
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| 67 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347622
(CHEMBL1803049)Show SMILES CCCCn1cc(CCCOc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C28H39N5O3/c1-4-5-14-33-22-24(29-30-33)9-8-19-36-27-13-12-23(20-28(27)35-3)21-31-15-17-32(18-16-31)25-10-6-7-11-26(25)34-2/h6-7,10-13,20,22H,4-5,8-9,14-19,21H2,1-3H3 | PDB
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| 67 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347624
(CHEMBL1803051)Show SMILES CCOCCn1cc(COc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C26H35N5O4/c1-4-34-16-15-31-19-22(27-28-31)20-35-25-10-9-21(17-26(25)33-3)18-29-11-13-30(14-12-29)23-7-5-6-8-24(23)32-2/h5-10,17,19H,4,11-16,18,20H2,1-3H3 | PDB
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| 68 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from human D2long receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347621
(CHEMBL1803030)Show SMILES CCCCn1cc(COc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C26H35N5O3/c1-4-5-12-31-19-22(27-28-31)20-34-25-11-10-21(17-26(25)33-3)18-29-13-15-30(16-14-29)23-8-6-7-9-24(23)32-2/h6-11,17,19H,4-5,12-16,18,20H2,1-3H3 | PDB
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| 70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347635
(CHEMBL1803029)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C56H76N10O9/c1-67-51-15-7-5-13-49(51)63-25-21-61(22-26-63)41-45-17-19-53(55(39-45)69-3)74-31-9-11-47-43-65(59-57-47)29-33-71-35-37-73-38-36-72-34-30-66-44-48(58-60-66)12-10-32-75-54-20-18-46(40-56(54)70-4)42-62-23-27-64(28-24-62)50-14-6-8-16-52(50)68-2/h5-8,13-20,39-40,43-44H,9-12,21-38,41-42H2,1-4H3 | PDB
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| 72 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347632
(CHEMBL1803026)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCCc3cn(CCCCCCCCCCn4cc(CCCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C60H84N10O6/c1-71-55-25-13-11-23-53(55)67-37-33-65(34-38-67)45-49-27-29-57(59(43-49)73-3)75-41-19-15-21-51-47-69(63-61-51)31-17-9-7-5-6-8-10-18-32-70-48-52(62-64-70)22-16-20-42-76-58-30-28-50(44-60(58)74-4)46-66-35-39-68(40-36-66)54-24-12-14-26-56(54)72-2/h11-14,23-30,43-44,47-48H,5-10,15-22,31-42,45-46H2,1-4H3 | PDB
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| 74 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347630
(CHEMBL1803024)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C56H76N10O6/c1-67-51-21-11-9-19-49(51)63-33-29-61(30-34-63)41-45-23-25-53(55(39-45)69-3)71-37-15-17-47-43-65(59-57-47)27-13-7-5-6-8-14-28-66-44-48(58-60-66)18-16-38-72-54-26-24-46(40-56(54)70-4)42-62-31-35-64(36-32-62)50-20-10-12-22-52(50)68-2/h9-12,19-26,39-40,43-44H,5-8,13-18,27-38,41-42H2,1-4H3 | PDB
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| 84 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(Sus scrofa) | BDBM21398
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2 | PDB
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| 93 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from D1 receptor from porcine cerebral cortex homogenates |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347631
(CHEMBL1803025)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C58H80N10O6/c1-69-53-23-13-11-21-51(53)65-35-31-63(32-36-65)43-47-25-27-55(57(41-47)71-3)73-39-17-19-49-45-67(61-59-49)29-15-9-7-5-6-8-10-16-30-68-46-50(60-62-68)20-18-40-74-56-28-26-48(42-58(56)72-4)44-64-33-37-66(38-34-64)52-22-12-14-24-54(52)70-2/h11-14,21-28,41-42,45-46H,5-10,15-20,29-40,43-44H2,1-4H3 | PDB
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| 96 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347628
(CHEMBL1803055)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)C6CCCCC6)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C55H80N10O5/c1-66-51-22-12-11-21-50(51)63-35-31-61(32-36-63)42-46-24-26-53(55(40-46)68-3)70-38-16-18-48-44-65(59-57-48)28-14-7-5-4-6-13-27-64-43-47(56-58-64)17-15-37-69-52-25-23-45(39-54(52)67-2)41-60-29-33-62(34-30-60)49-19-9-8-10-20-49/h11-12,21-26,39-40,43-44,49H,4-10,13-20,27-38,41-42H2,1-3H3 | PDB
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| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50347624
(CHEMBL1803051)Show SMILES CCOCCn1cc(COc2ccc(CN3CCN(CC3)c3ccccc3OC)cc2OC)nn1 Show InChI InChI=1S/C26H35N5O4/c1-4-34-16-15-31-19-22(27-28-31)20-35-25-10-9-21(17-26(25)33-3)18-29-11-13-30(14-12-29)23-7-5-6-8-24(23)32-2/h5-10,17,19H,4,11-16,18,20H2,1-3H3 | PDB
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| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D2short receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(Sus scrofa) | BDBM50347629
(CHEMBL1803023)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCc1cn(CCCCCCCCn2cc(COc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C52H68N10O6/c1-63-47-17-11-9-15-45(47)59-29-25-57(26-30-59)35-41-19-21-49(51(33-41)65-3)67-39-43-37-61(55-53-43)23-13-7-5-6-8-14-24-62-38-44(54-56-62)40-68-50-22-20-42(34-52(50)66-4)36-58-27-31-60(32-28-58)46-16-10-12-18-48(46)64-2/h9-12,15-22,33-34,37-38H,5-8,13-14,23-32,35-36,39-40H2,1-4H3 | PDB
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| 210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from D1 receptor from porcine cerebral cortex homogenates |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(Sus scrofa) | BDBM50347630
(CHEMBL1803024)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C56H76N10O6/c1-67-51-21-11-9-19-49(51)63-33-29-61(30-34-63)41-45-23-25-53(55(39-45)69-3)71-37-15-17-47-43-65(59-57-47)27-13-7-5-6-8-14-28-66-44-48(58-60-66)18-16-38-72-54-26-24-46(40-56(54)70-4)42-62-31-35-64(36-32-62)50-20-10-12-22-52(50)68-2/h9-12,19-26,39-40,43-44H,5-8,13-18,27-38,41-42H2,1-4H3 | PDB
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| 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from D1 receptor from porcine cerebral cortex homogenates |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347627
(CHEMBL1803054)Show SMILES COc1cc(CN2CCN(C)CC2)ccc1OCCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C50H72N10O5/c1-55-25-27-56(28-26-55)37-41-19-21-47(49(35-41)62-3)64-33-13-15-43-39-59(53-51-43)23-11-7-5-6-8-12-24-60-40-44(52-54-60)16-14-34-65-48-22-20-42(36-50(48)63-4)38-57-29-31-58(32-30-57)45-17-9-10-18-46(45)61-2/h9-10,17-22,35-36,39-40H,5-8,11-16,23-34,37-38H2,1-4H3 | PDB
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| 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(Sus scrofa) | BDBM50347634
(CHEMBL1803028)Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCCc1cn(CCOCCOCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C54H72N10O8/c1-65-49-15-7-5-13-47(49)61-25-21-59(22-26-61)39-43-17-19-51(53(37-43)67-3)71-31-9-11-45-41-63(57-55-45)29-33-69-35-36-70-34-30-64-42-46(56-58-64)12-10-32-72-52-20-18-44(38-54(52)68-4)40-60-23-27-62(28-24-60)48-14-6-8-16-50(48)66-2/h5-8,13-20,37-38,41-42H,9-12,21-36,39-40H2,1-4H3 | PDB
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| 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from D1 receptor from porcine cerebral cortex homogenates |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50347626
(CHEMBL1803053)Show SMILES CCCc1cn(CCCCCCCCn2cc(CCCOc3ccc(CN4CCN(CC4)c4ccccc4OC)cc3OC)nn2)nn1 Show InChI InChI=1S/C37H54N8O3/c1-4-14-32-29-44(40-38-32)20-11-7-5-6-8-12-21-45-30-33(39-41-45)15-13-26-48-36-19-18-31(27-37(36)47-3)28-42-22-24-43(25-23-42)34-16-9-10-17-35(34)46-2/h9-10,16-19,27,29-30H,4-8,11-15,20-26,28H2,1-3H3 | PDB
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| 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(Sus scrofa) | BDBM50347631
(CHEMBL1803025)Show SMILES COc1ccccc1N1CCN(Cc2ccc(OCCCc3cn(CCCCCCCCCCn4cc(CCCOc5ccc(CN6CCN(CC6)c6ccccc6OC)cc5OC)nn4)nn3)c(OC)c2)CC1 Show InChI InChI=1S/C58H80N10O6/c1-69-53-23-13-11-21-51(53)65-35-31-63(32-36-65)43-47-25-27-55(57(41-47)71-3)73-39-17-19-49-45-67(61-59-49)29-15-9-7-5-6-8-10-16-30-68-46-50(60-62-68)20-18-40-74-56-28-26-48(42-58(56)72-4)44-64-33-37-66(38-34-64)52-22-12-14-24-54(52)70-2/h11-14,21-28,41-42,45-46H,5-10,15-20,29-40,43-44H2,1-4H3 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University
Curated by ChEMBL
| Assay Description
Displacement of [3H]SCH23390 from D1 receptor from porcine cerebral cortex homogenates |
J Med Chem 54: 4896-903 (2011)
Article DOI: 10.1021/jm2004859
BindingDB Entry DOI: 10.7270/Q2RB74ZR |
More data for this
Ligand-Target Pair | |
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