Found 10 hits of Enzyme Inhibition Constant Data 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
(RAT) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | Reactome pathway
UniProtKB/SwissProt
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PC sid
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Similars
| PubMed
| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
D(4) dopamine receptor
(Homo sapiens (Human)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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PC cid
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| 10.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Rattus norvegicus (rat)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| 1.64E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
Alpha-2C adrenergic receptor
(RAT) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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| 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
D(3) dopamine receptor
(Rattus norvegicus (Rat)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | KEGG
UniProtKB/SwissProt
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| 2.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
Alpha-1A adrenergic receptor
(Rattus norvegicus (Rat)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
KEGG
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| 4.14E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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PC cid
PC sid
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| 5.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(COW) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | UniProtKB/SwissProt
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| 7.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
D(1A) dopamine receptor
(RAT) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Similars
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| 8.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50051563
(4-[4-((R)-2-Isochroman-1-yl-ethyl)-piperazin-1-yl]...)Show SMILES NS(=O)(=O)c1ccc(cc1)N1CCN(CC[C@H]2OCCc3ccccc23)CC1 Show InChI InChI=1S/C21H27N3O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21/h1-8,21H,9-16H2,(H2,22,25,26)/t21-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
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| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pharmacia and Upjohn, Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 279: 1392-403 (1996)
BindingDB Entry DOI: 10.7270/Q2SQ8XX9 |
More data for this
Ligand-Target Pair | |
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