Found 147 hits with Last Name = 'bordeleau' and Initial = 'm' 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(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84440
(Isoindoline, 7 | Isoindoline, 8 | Isoindoline, 9)Show SMILES OCC(CN1Cc2ccccc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H26FN3O2/c24-19-5-6-21-22(11-19)29-25-23(21)16-7-9-27(10-8-16)20(15-28)14-26-12-17-3-1-2-4-18(17)13-26/h1-6,11,16,20,28H,7-10,12-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84445
(Isoindoline, 12)Show SMILES OCC(CN1Cc2cccc(F)c2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H25F2N3O2/c24-17-4-5-19-22(10-17)30-26-23(19)15-6-8-28(9-7-15)18(14-29)12-27-11-16-2-1-3-21(25)20(16)13-27/h1-5,10,15,18,29H,6-9,11-14H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84451
(Isoindoline, 18 | Isoindoline, 19)Show SMILES COc1ccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc2c1 Show InChI InChI=1S/C24H28FN3O3/c1-30-21-4-2-17-12-27(13-18(17)10-21)14-20(15-29)28-8-6-16(7-9-28)24-22-5-3-19(25)11-23(22)31-26-24/h2-5,10-11,16,20,29H,6-9,12-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84440
(Isoindoline, 7 | Isoindoline, 8 | Isoindoline, 9)Show SMILES OCC(CN1Cc2ccccc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H26FN3O2/c24-19-5-6-21-22(11-19)29-25-23(21)16-7-9-27(10-8-16)20(15-28)14-26-12-17-3-1-2-4-18(17)13-26/h1-6,11,16,20,28H,7-10,12-15H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84443
(Isoindoline, 10 | Isoindoline, 11)Show SMILES OCC(CN1Cc2ccc(F)cc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H25F2N3O2/c24-18-2-1-16-11-27(12-17(16)9-18)13-20(14-29)28-7-5-15(6-8-28)23-21-4-3-19(25)10-22(21)30-26-23/h1-4,9-10,15,20,29H,5-8,11-14H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84446
(Isoindoline, 13)Show SMILES OCC(CN1Cc2ccc(Cl)cc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H25ClFN3O2/c24-18-2-1-16-11-27(12-17(16)9-18)13-20(14-29)28-7-5-15(6-8-28)23-21-4-3-19(25)10-22(21)30-26-23/h1-4,9-10,15,20,29H,5-8,11-14H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84453
(Isoindoline, 20)Show SMILES COc1cccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc12 Show InChI InChI=1S/C24H28FN3O3/c1-30-22-4-2-3-17-12-27(14-21(17)22)13-19(15-29)28-9-7-16(8-10-28)24-20-6-5-18(25)11-23(20)31-26-24/h2-6,11,16,19,29H,7-10,12-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152303
(CHEMBL361035 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-9-4-8-18(14-19)21-10-5-13-26-21)23-20-11-12-24(16-20)15-17-6-2-1-3-7-17/h1-10,13-14,20H,11-12,15-16H2,(H,23,25)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152303
(CHEMBL361035 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-9-4-8-18(14-19)21-10-5-13-26-21)23-20-11-12-24(16-20)15-17-6-2-1-3-7-17/h1-10,13-14,20H,11-12,15-16H2,(H,23,25)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50152314
((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152296
(CHEMBL364782 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-4-...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)/t21-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152298
(CHEMBL426062 | N-((S)-1-Benzyl-pyrrolidin-3-yl)-3-...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-4-7-18(13-19)20-10-12-26-16-20)23-21-9-11-24(15-21)14-17-5-2-1-3-6-17/h1-8,10,12-13,16,21H,9,11,14-15H2,(H,23,25)/t21-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152306
(CHEMBL187122 | N-(1-Benzyl-pyrrolidin-3-yl)-4-thio...)Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152297
(CHEMBL187236 | N-(1-Benzyl-pyrrolidin-3-yl)-4-thio...)Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152314
((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152314
((S)-N-(1-benzylpyrrolidin-3-yl)-4-(thiophen-2-yl)b...)Show SMILES O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-10-8-18(9-11-19)21-7-4-14-26-21)23-20-12-13-24(16-20)15-17-5-2-1-3-6-17/h1-11,14,20H,12-13,15-16H2,(H,23,25)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152305
(Biphenyl-4-carboxylic acid (1-benzyl-pyrrolidin-3-...)Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H24N2O/c27-24(22-13-11-21(12-14-22)20-9-5-2-6-10-20)25-23-15-16-26(18-23)17-19-7-3-1-4-8-19/h1-14,23H,15-18H2,(H,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152302
(CHEMBL187113 | N-((R)-1-Benzyl-pyrrolidin-3-yl)-3-...)Show SMILES O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-4-7-18(13-19)20-10-12-26-16-20)23-21-9-11-24(15-21)14-17-5-2-1-3-6-17/h1-8,10,12-13,16,21H,9,11,14-15H2,(H,23,25)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84459
(Isoindoline, 26)Show SMILES OCC(CN1CCc2ccccc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C24H28FN3O2/c25-20-5-6-22-23(13-20)30-26-24(22)18-8-11-28(12-9-18)21(16-29)15-27-10-7-17-3-1-2-4-19(17)14-27/h1-6,13,18,21,29H,7-12,14-16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84449
(Isoindoline, 16)Show SMILES Cc1cccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc12 Show InChI InChI=1S/C24H28FN3O2/c1-16-3-2-4-18-12-27(14-22(16)18)13-20(15-29)28-9-7-17(8-10-28)24-21-6-5-19(25)11-23(21)30-26-24/h2-6,11,17,20,29H,7-10,12-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| 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 |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152309
(Biphenyl-3-carboxylic acid (1-benzyl-pyrrolidin-3-...)Show SMILES O=C(NC1CCN(Cc2ccccc2)C1)c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C24H24N2O/c27-24(22-13-7-12-21(16-22)20-10-5-2-6-11-20)25-23-14-15-26(18-23)17-19-8-3-1-4-9-19/h1-13,16,23H,14-15,17-18H2,(H,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174001
(CHEMBL381019 | N-[(S)-1-(4-Methyl-benzyl)-pyrrolid...)Show SMILES Cc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H24N2OS/c1-17-7-9-18(10-8-17)15-25-12-11-21(16-25)24-23(26)20-5-2-4-19(14-20)22-6-3-13-27-22/h2-10,13-14,21H,11-12,15-16H2,1H3,(H,24,26)/t21-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84456
(Isoindoline, 23)Show SMILES OCC(CN1Cc2ccccc2C1=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H24FN3O3/c24-17-5-6-20-21(11-17)30-25-22(20)15-7-9-26(10-8-15)18(14-28)13-27-12-16-3-1-2-4-19(16)23(27)29/h1-6,11,15,18,28H,7-10,12-14H2 | Reactome pathway
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84448
(Isoindoline, 15)Show SMILES Cc1ccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc2c1 Show InChI InChI=1S/C24H28FN3O2/c1-16-2-3-18-12-27(13-19(18)10-16)14-21(15-29)28-8-6-17(7-9-28)24-22-5-4-20(25)11-23(22)30-26-24/h2-5,10-11,17,21,29H,6-9,12-15H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174000
((S)-N-(1-(4-fluorobenzyl)pyrrolidin-3-yl)-4-(thiop...)Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21FN2OS/c23-19-9-3-16(4-10-19)14-25-12-11-20(15-25)24-22(26)18-7-5-17(6-8-18)21-2-1-13-27-21/h1-10,13,20H,11-12,14-15H2,(H,24,26)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152311
(4''-Chloro-biphenyl-4-carboxylic acid (1-benzyl-py...)Show SMILES Clc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23ClN2O/c25-22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(28)26-23-14-15-27(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,26,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84456
(Isoindoline, 23)Show SMILES OCC(CN1Cc2ccccc2C1=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H24FN3O3/c24-17-5-6-20-21(11-17)30-25-22(20)15-7-9-26(10-8-15)18(14-28)13-27-12-16-3-1-2-4-19(16)23(27)29/h1-6,11,15,18,28H,7-10,12-14H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174006
((S)-N-(1-(benzo[d][1,3]dioxol-5-ylmethyl)pyrrolidi...)Show SMILES O=C(N[C@H]1CCN(Cc2ccc3OCOc3c2)C1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C23H22N2O3S/c26-23(18-6-4-17(5-7-18)22-2-1-11-29-22)24-19-9-10-25(14-19)13-16-3-8-20-21(12-16)28-15-27-20/h1-8,11-12,19H,9-10,13-15H2,(H,24,26)/t19-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152310
(4''-Fluoro-biphenyl-4-carboxylic acid (1-benzyl-py...)Show SMILES Fc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23FN2O/c25-22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(28)26-23-14-15-27(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,26,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84446
(Isoindoline, 13)Show SMILES OCC(CN1Cc2ccc(Cl)cc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C23H25ClFN3O2/c24-18-2-1-16-11-27(12-17(16)9-18)13-20(14-29)28-7-5-15(6-8-28)23-21-4-3-19(25)10-22(21)30-26-23/h1-4,9-10,15,20,29H,5-8,11-14H2 | Reactome pathway
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 11.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84449
(Isoindoline, 16)Show SMILES Cc1cccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc12 Show InChI InChI=1S/C24H28FN3O2/c1-16-3-2-4-18-12-27(14-22(16)18)13-20(15-29)28-9-7-17(8-10-28)24-21-6-5-19(25)11-23(21)30-26-24/h2-6,11,17,20,29H,7-10,12-15H2,1H3 | Reactome pathway
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50174000
((S)-N-(1-(4-fluorobenzyl)pyrrolidin-3-yl)-4-(thiop...)Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21FN2OS/c23-19-9-3-16(4-10-19)14-25-12-11-20(15-25)24-22(26)18-7-5-17(6-8-18)21-2-1-13-27-21/h1-10,13,20H,11-12,14-15H2,(H,24,26)/t20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174003
((S)-N-(1-(3-methoxybenzyl)pyrrolidin-3-yl)-4-(thio...)Show SMILES COc1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H24N2O2S/c1-27-21-5-2-4-17(14-21)15-25-12-11-20(16-25)24-23(26)19-9-7-18(8-10-19)22-6-3-13-28-22/h2-10,13-14,20H,11-12,15-16H2,1H3,(H,24,26)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174008
((S)-N-(1-(3,4-difluorobenzyl)pyrrolidin-3-yl)-4-(t...)Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1F Show InChI InChI=1S/C22H20F2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174011
((S)-N-(1-(4-(trifluoromethyl)benzyl)pyrrolidin-3-y...)Show SMILES FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-9-3-16(4-10-19)14-28-12-11-20(15-28)27-22(29)18-7-5-17(6-8-18)21-2-1-13-30-21/h1-10,13,20H,11-12,14-15H2,(H,27,29)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174010
((S)-N-(1-(3,4-dichlorobenzyl)pyrrolidin-3-yl)-4-(t...)Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1Cl Show InChI InChI=1S/C22H20Cl2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50174008
((S)-N-(1-(3,4-difluorobenzyl)pyrrolidin-3-yl)-4-(t...)Show SMILES Fc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1F Show InChI InChI=1S/C22H20F2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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 |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174004
(CHEMBL197381 | N-((S)-1-(4-chlorobenzyl)pyrrolidin...)Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C22H21ClN2OS/c23-19-8-6-16(7-9-19)14-25-11-10-20(15-25)24-22(26)18-4-1-3-17(13-18)21-5-2-12-27-21/h1-9,12-13,20H,10-11,14-15H2,(H,24,26)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152308
(4''-Methylsulfanyl-biphenyl-4-carboxylic acid (1-b...)Show SMILES CSc1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C25H26N2OS/c1-29-24-13-11-21(12-14-24)20-7-9-22(10-8-20)25(28)26-23-15-16-27(18-23)17-19-5-3-2-4-6-19/h2-14,23H,15-18H2,1H3,(H,26,28) | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152312
(3''-Fluoro-biphenyl-4-carboxylic acid (1-benzyl-py...)Show SMILES Fc1cccc(c1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H23FN2O/c25-22-8-4-7-21(15-22)19-9-11-20(12-10-19)24(28)26-23-13-14-27(17-23)16-18-5-2-1-3-6-18/h1-12,15,23H,13-14,16-17H2,(H,26,28) | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152313
(4''-Trifluoromethyl-biphenyl-4-carboxylic acid (1-...)Show SMILES FC(F)(F)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C25H23F3N2O/c26-25(27,28)22-12-10-20(11-13-22)19-6-8-21(9-7-19)24(31)29-23-14-15-30(17-23)16-18-4-2-1-3-5-18/h1-13,23H,14-17H2,(H,29,31) | PDB
Reactome pathway
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| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84453
(Isoindoline, 20)Show SMILES COc1cccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc12 Show InChI InChI=1S/C24H28FN3O3/c1-30-22-4-2-3-17-12-27(14-21(17)22)13-19(15-29)28-9-7-16(8-10-28)24-20-6-5-18(25)11-23(20)31-26-24/h2-6,11,16,19,29H,7-10,12-15H2,1H3 | Reactome pathway
UniProtKB/SwissProt
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| 17.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50152301
(CHEMBL366304 | N-((R)-1-Benzyl-pyrrolidin-3-yl)-4-...)Show SMILES O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(cc1)-c1ccsc1 Show InChI InChI=1S/C22H22N2OS/c25-22(19-8-6-18(7-9-19)20-11-13-26-16-20)23-21-10-12-24(15-21)14-17-4-2-1-3-5-17/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)/t21-/m1/s1 | PDB
Reactome pathway
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| 18 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals Inc.
Curated by ChEMBL
| Assay Description
Ability to displace [3H]-spiperone from human Dopamine receptor D4.2 stably transfected in human embryonic kidney 298 cells |
Bioorg Med Chem Lett 14: 4847-50 (2004)
Article DOI: 10.1016/j.bmcl.2004.07.045
BindingDB Entry DOI: 10.7270/Q20C4V7D |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84459
(Isoindoline, 26)Show SMILES OCC(CN1CCc2ccccc2C1)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C24H28FN3O2/c25-20-5-6-22-23(13-20)30-26-24(22)18-8-11-28(12-9-18)21(16-29)15-27-10-7-17-3-1-2-4-19(17)14-27/h1-6,13,18,21,29H,7-12,14-16H2 | Reactome pathway
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| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM84450
(Isoindoline, 17)Show SMILES OCC(CN1Cc2ccc(cc2C1)C(F)(F)F)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C24H25F4N3O2/c25-19-3-4-21-22(10-19)33-29-23(21)15-5-7-31(8-6-15)20(14-32)13-30-11-16-1-2-18(24(26,27)28)9-17(16)12-30/h1-4,9-10,15,20,32H,5-8,11-14H2 | PDB
Reactome pathway
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| 19.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
Dopamine D4.2 and D2S receptor binding was performed at NPS Allexlix Corp. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
Alpha-1B adrenergic receptor
(Rattus norvegicus (rat)) | BDBM84451
(Isoindoline, 18 | Isoindoline, 19)Show SMILES COc1ccc2CN(CC(CO)N3CCC(CC3)c3noc4cc(F)ccc34)Cc2c1 Show InChI InChI=1S/C24H28FN3O3/c1-30-21-4-2-17-12-27(13-18(17)10-21)14-20(15-29)28-8-6-16(7-9-28)24-22-5-3-19(25)11-23(22)31-26-24/h2-5,10-11,16,20,29H,6-9,12-15H2,1H3 | Reactome pathway
UniProtKB/SwissProt
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| PC cid
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Aventis Pharmaceuticals
| Assay Description
All rat alpha-1 adrenoceptor binding was performed by Hugo M. vargas, Karen M. Brooks and Lynn Laws-Ricker. |
Chembiochem 3: 999-1009 (2002)
Article DOI: 10.1002/1439-7633(20021004)3:10
BindingDB Entry DOI: 10.7270/Q27D2SP5 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174002
(CHEMBL370652 | N-((S)-1-(4-(trifluoromethyl)benzyl...)Show SMILES FC(F)(F)c1ccc(CN2CC[C@@H](C2)NC(=O)c2cccc(c2)-c2cccs2)cc1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-8-6-16(7-9-19)14-28-11-10-20(15-28)27-22(29)18-4-1-3-17(13-18)21-5-2-12-30-21/h1-9,12-13,20H,10-11,14-15H2,(H,27,29)/t20-/m0/s1 | PDB
Reactome pathway
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| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50174003
((S)-N-(1-(3-methoxybenzyl)pyrrolidin-3-yl)-4-(thio...)Show SMILES COc1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H24N2O2S/c1-27-21-5-2-4-17(14-21)15-25-12-11-20(16-25)24-23(26)19-9-7-18(8-10-19)22-6-3-13-28-22/h2-10,13-14,20H,11-12,15-16H2,1H3,(H,24,26)/t20-/m0/s1 | PDB
MMDB
Reactome pathway
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50174012
((S)-N-(1-(3-(trifluoromethyl)benzyl)pyrrolidin-3-y...)Show SMILES FC(F)(F)c1cccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)c1 Show InChI InChI=1S/C23H21F3N2OS/c24-23(25,26)19-4-1-3-16(13-19)14-28-11-10-20(15-28)27-22(29)18-8-6-17(7-9-18)21-5-2-12-30-21/h1-9,12-13,20H,10-11,14-15H2,(H,27,29)/t20-/m0/s1 | PDB
Reactome pathway
KEGG
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]spiperone from cloned human dopamine D4.2 receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50174010
((S)-N-(1-(3,4-dichlorobenzyl)pyrrolidin-3-yl)-4-(t...)Show SMILES Clc1ccc(CN2CC[C@@H](C2)NC(=O)c2ccc(cc2)-c2cccs2)cc1Cl Show InChI InChI=1S/C22H20Cl2N2OS/c23-19-8-3-15(12-20(19)24)13-26-10-9-18(14-26)25-22(27)17-6-4-16(5-7-17)21-2-1-11-28-21/h1-8,11-12,18H,9-10,13-14H2,(H,25,27)/t18-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NPS Pharmaceuticals
Curated by ChEMBL
| Assay Description
Displacement of [3H]ketanserin from cloned human 5HT2A receptor in HEK298 cells |
Bioorg Med Chem Lett 15: 5253-6 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.051
BindingDB Entry DOI: 10.7270/Q26D5TSR |
More data for this
Ligand-Target Pair | |
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