Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Alpha-1A/Alpha-2A adrenergic receptor | ||
| Ligand | BDBM50017543 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_30242 (CHEMBL644381) | ||
| IC50 | 41±n/a nM | ||
| Citation |  Anderson, PS; Baldwin, JJ; McClure, DE; Lundell, GF; Jones, JH; Randall, WC; Martin, GE; Williams, M; Hirshfield, JM; Clineschmidt, BV; Lumma, PK; Remy, DC Synthesis of (7R)-7H-indolo[3,4-gh][1,4]benzoxazines, a new class of D-heteroergolines with dopamine agonist activity. J Med Chem26:363-7 (1983) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Alpha-1A/Alpha-2A adrenergic receptor | |||
| Name: | Alpha-1A/Alpha-2A adrenergic receptor | ||
| Synonyms: | Cerebral cortex alpha adrenergic receptor | ||
| Type: | n/a | ||
| Mol. Mass.: | n/a | ||
| Description: | ASSAY_ID of ChEMBL is 30242 | ||
| Components: | This complex has 2 components. | ||
| Component 1 | |||
| Name: | Alpha-1A adrenergic receptor | ||
| Synonyms: | ADA1A_BOVIN | ADRA1A | ADRA1C | Alpha 1A-adrenoceptor | Alpha 1A-adrenoreceptor | Alpha-1C adrenergic receptor | Cerebral cortex alpha adrenergic receptor | adrenergic Alpha1 | ||
| Type: | Enzyme Catalytic Domain | ||
| Mol. Mass.: | 51492.08 | ||
| Organism: | CALF | ||
| Description: | adrenergic Alpha1 0 CALF | ||
| Residue: | 466 | ||
| Sequence: |
| ||
| Component 2 | |||
| Name: | Alpha-2A adrenergic receptor | ||
| Synonyms: | ADA2A_BOVIN | ADRA2A | Alpha-2A adrenergic receptor | Alpha-2A adrenoceptor | Alpha-2A adrenoreceptor | Alpha-2AAR | Alpha-2D adrenergic receptor | Alpha-2Da adrenergic receptor | Cerebral cortex alpha adrenergic receptor | adrenergic Alpha2A | adrenergic Alpha2D | ||
| Type: | Enzyme Catalytic Domain | ||
| Mol. Mass.: | 49275.13 | ||
| Organism: | BOVINE | ||
| Description: | adrenergic Alpha2 0 BOVINE::Q28838 | ||
| Residue: | 452 | ||
| Sequence: |
| ||
| BDBM50017543 | |||
| n/a | |||
| Name | BDBM50017543 | ||
| Synonyms: | (6aR,9R,10aR)-9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinolin-7-ium | (6aR,9R,10aR)-9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinoline | 5-Bromo-7-methyl-4,6,6a,7,8,9-hexahydro-indolo[4,3-fg]quinoline-9-carboxylic acid (10b-hydroxy-5-isobutyl-2-isopropyl-3,6-dioxo-octahydro-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-amide | 9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinolin-7-ium(Pergolide) | 9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinoline | 9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinoline(pergolide) | 9-Methylsulfanylmethyl-7-propyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinoline, mesylate (Pergolide) | CHEMBL531 | PERGOLIDE | Permax | [2-(1H-Indol-4-yl)-ethyl]-methyl-amine | cid_47811 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H26N2S | ||
| Mol. Mass. | 314.488 | ||
| SMILES | CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13 |r| | ||
| Structure | 
| ||