Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T22118 | Target Info | |||
| Target Name | Dopamine D1 receptor (D1R) | ||||
| Synonyms |
D(1A) dopamine receptor
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| Target Type | Successful Target | ||||
| Gene Name | DRD1 | ||||
| Biochemical Class | GPCR rhodopsin | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 13 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Isoproterenol
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Approved | Compound Info | ||
| Synonyms |
isoproterenol; Isoprenaline; Isoprenalin; Norisodrine; Novodrin; Isopropydrin; Isopropylarterenol; Respifral; Assiprenol; Asiprenol; Bellasthman; Asmalar; Aludrine; Aludrin; N-Isopropylnoradrenaline; Bronkephrine; Neodrenal; Lomupren; Isonorene; Isopropyladrenaline; 7683-59-2; N-Isopropylnorepinephrine; Isopropylnorepinephrine; neo-Epinine; Isadrine; Saventrine; Isorenin; Isonorin; Proternol; Isopropylnoradrenaline; Isopropyl noradrenaline; Racemic isoprenaline; dl-Isadrine; Racemic isoproterenol; (+-)-Isoproterenol; Vapo-N-iso; Aerolone; Aleudrine; Dihydroxyphenylethanolisopropylamine; Euspiran; ISOPROP; Isadrin; Isoproterenolum; Isuprel; Isupren; Izadrin; Epinephrine isopropyl homolog; Isoprenaline hydrochloride; Isoproterenol Chloride; Isoproterenol [JAN]; Isuprel Mistometer; WIN 5162; D-Isoprenaline; D-Isopropylarterenol; D-Isoproterenol; DL-Isopropylnorepinephrine; Dl-Ipr; Dl-Isadrine; Dl-Isopropylnoradrenaline; Isoprenalina [INN-Spanish]; Isoprenaline (INN); Isoprenalinum [INN-Latin]; Isuprel (TN); L-Isopropylnoradrenaline; L-Isoproterenol; Medihaler-ISO; Neo-Epinine; Vapo-Iso; Alpha-(Isopropylaminomethyl)protocatechuyl alcohol; Alpha-(Isopropylaminomoethyl)protocatechuyl alcohol; D-N-Isopropylnorepinephrine; Dl-N-Isopropylnoradrenaline; Isopropylaminomethyl(3,4-dihydroxyphenyl)carbinol; Isopropylaminomethyl-3,4-dihydroxyphenyl carbinol; DL(+-)-Isoproterenol; N-Isopropyl-beta-dihydroxyphenyl-beta-hydroxyethylamine; (+)-Isoprenaline; (+)-Isoproterenol; (+-)-Isoprenaline; (-)-Isoproterenol hydrochloride; (S)-(+)-Isoproterenol; (S)-Isoprenaline; (S)-Isoproterenol; 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-(9CI); 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (S)-(9CI); 1-(3,4-Dihydroxyphenyl)-2-(isopropylamino)ethanol; 1-(3,4-Dihydroxyphenyl)-2-isopropylaminoethanol; 3,4-Dihydroxy-alpha-(isopropylaminomethyl)-benzyl alcohol; 3,4-Dihydroxy-alpha-[(isopropylamino)methyl]benzyl alcohol; 3,4-Dihydroxy-alpha-((isopropylamino)methyl)benzyl alcohol; 4-(1-Hydroxy-2(isopropylamino)ethyl)-benzene 1,2-diol; 4-(1-Hydroxy-2-((1-methylethyl)amino)ethyl)-1,2-benzenediol; 4-{1-hydroxy-2-[(1-methylethyl)amino]ethyl}benzene-1,2-diol; AS1409
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| Activity |
Ki ~ 50000 nM
|
[1] | |||
| Compound Name |
2-[[(2R)-2-Phenethylmorpholino]methyl]-1H-benzoimidazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3335537; BDBM50027074
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| Activity |
Ki ~ 100000 nM
|
[2] | |||
| Compound Name |
4-(1H-Benzimidazol-2-ylmethyl)-2-(2-phenylethyl)morpholine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3335535; SCHEMBL8926632; BDBM50027072; MCULE-2416114663; L013202
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| Activity |
Ki ~ 100000 nM
|
[3] | |||
| Compound Name |
[(1R,2S,5S,6S,7S)-3-Benzyl-7-(diethylamino)-2-pyridin-2-yl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062858; BDBM50389450
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Compound Name |
(2S)-4-(1H-Benzimidazol-2-ylmethyl)-2-(2-phenylethyl)morpholine
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3335536; BDBM50027077
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| Activity |
Ki ~ 100000 nM
|
[3] | |||
| Compound Name |
4-Methyl-5-[4-methyl-5-[3-[(2S,3R)-2-phenyl-5-azaspiro[2.4]heptan-5-yl]propylsulfanyl]-1,2,4-triazol-3-yl]-1,3-oxazole
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3983937; SCHEMBL17712767; BDBM50192034
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| Activity |
Ki ~ 100000 nM
|
[5] | |||
| Compound Name |
[(1S,2R,5S,6S,7S)-3-Benzyl-2-methyl-7-pyrrolidin-1-yl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062854; BDBM50389443
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Compound Name |
[(1S,2R,5S,6S,7S)-3-Benzyl-7-(diethylamino)-2-methyl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062852; BDBM50389441
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Compound Name |
CN1C(Scccn2ccoc(C2)C2=CC=C(C=C2)C(F)(F)F)=NN=C1C1=C(C)N=CO1
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3764557; SCHEMBL18741905; BDBM50139861
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| Activity |
Ki ~ 100000 nM
|
[6] | |||
| Compound Name |
(+)-Govadine HCl
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1950492
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| Activity |
EC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
[(1R,2S,5R,6R,7R)-3-Benzyl-2-methyl-7-pyrrolidin-1-yl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062855; BDBM50389444
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Compound Name |
[(1S,2R,5R,6R,7R)-3-Benzyl-7-(diethylamino)-2-pyridin-2-yl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062859; BDBM50389447
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|
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Compound Name |
[(1R,2S,5R,6R,7R)-3-Benzyl-7-(diethylamino)-2-methyl-3-azabicyclo[3.2.0]heptan-6-yl]methanol
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2062853; BDBM50389442
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| Activity |
Ki ~ 100000 nM
|
[4] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 1 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
tyramine
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|
Investigative | Compound Info | ||
| Synonyms |
Tyramine; 4-(2-Aminoethyl)phenol; 51-67-2; 4-Hydroxyphenethylamine; p-Tyramine; 2-(4-Hydroxyphenyl)ethylamine; Uteramine; Tyramin; Tyrosamine; Tocosine; 4-Hydroxyphenylethylamine; Systogene; Phenol, 4-(2-aminoethyl)-; p-Hydroxyphenethylamine; Tenosin-wirkstoff; p-Hydroxyphenylethylamine; p-(2-Aminoethyl)phenol; 2-(p-Hydroxyphenyl)ethylamine; Phenethylamine, p-hydroxy-; p-beta-Aminoethylphenol; Phenol, p-(2-aminoethyl)-; Benzeneethanamine, 4-hydroxy-; Tyramine base; beta-Hydroxyphenylethylamine; NSC 249188; p-tyramine; [3H]tyramine
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| Activity |
Ki = 390000 nM
|
[8] | |||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structure-guided development of dual 2 adrenergic/dopamine D2 receptor agonists. Bioorg Med Chem. 2016 Jun 15;24(12):2641-53. | ||||
| REF 2 | Return of D 4 Dopamine Receptor Antagonists in Drug Discovery. J Med Chem. 2017 Sep 14;60(17):7233-7243. | ||||
| REF 3 | Discovery and Characterization of ML398, a Potent and Selective Antagonist of the D4 Receptor with in Vivo Activity. ACS Med Chem Lett. 2014 Jul 9;5(9):1060-4. | ||||
| REF 4 | Chemoenzymatic synthesis and evaluation of 3-azabicyclo[3.2.0]heptane derivatives as dopaminergic ligands. Eur J Med Chem. 2012 Sep;55:255-61. | ||||
| REF 5 | 1,2,4-Triazolyl 5-Azaspiro[2.4]heptanes: Lead Identification and Early Lead Optimization of a New Series of Potent and Selective Dopamine D3 Receptor Antagonists. J Med Chem. 2016 Sep 22;59(18):8549-76. | ||||
| REF 6 | Novel morpholine scaffolds as selective dopamine (DA) D3 receptor antagonists. Bioorg Med Chem Lett. 2016 Feb 15;26(4):1329-32. | ||||
| REF 7 | First enantioselective syntheses of the dopamine D1 and D2 receptor modulators, (+)- and (-)-govadine. Bioorg Med Chem Lett. 2012 Feb 15;22(4):1557-9. | ||||
| REF 8 | CoMFA-based prediction of agonist affinities at recombinant D1 vs D2 dopamine receptors. J Med Chem. 1998 Oct 22;41(22):4385-99. | ||||
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