Reaction Details |
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Target | Beta-1/Beta-2/Beta-3 adrenergic receptor |
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Ligand | BDBM50019061 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_41763 (CHEMBL650213) |
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EC50 | >10000±n/a nM |
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Citation | Chen, GT; King, M; Gusovsky, F; Creveling, CR; Daly, JW; Chen, BH; Nie, JY; Kirk, KL Syntheses of 2,5- and 2,6-difluoronorepinephrine, 2,5-difluoroepinephrine, and 2,6-difluorophenylephrine: effect of disubstitution with fluorine on adrenergic activity. J Med Chem36:3947-55 (1994) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Beta-1/Beta-2/Beta-3 adrenergic receptor |
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Name: | Beta-1/Beta-2/Beta-3 adrenergic receptor |
Synonyms: | Adrenergic receptor beta |
Type: | n/a |
Mol. Mass.: | n/a |
Description: | ASSAY_ID of ChEMBL is 1340543 |
Components: | This complex has 3 components. |
Component 1 |
Name: | Beta-1 adrenergic receptor |
Synonyms: | ADRB1R, B1AR | ADRB1_RAT | Adrb1 | Adrb1r | Adrenergic receptor beta | Beta-1 adrenoceptor | Beta-1 adrenoreceptor | adrenergic Beta1 | adrenergic Beta1,2 |
Type: | Protein |
Mol. Mass.: | 50486.84 |
Organism: | Rattus norvegicus (Rat) |
Description: | P18090 |
Residue: | 466 |
Sequence: | MGAGALALGASEPCNLSSAAPLPDGAATAARLLVLASPPASLLPPASEGSAPLSQQWTAG
MGLLLALIVLLIVVGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVV
WGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITLPFRYQSLLTRARARALVC
TVWAISALVSFLPILMHWWRAESDEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIM
AFVYLRVFREAQKQVKKIDSCERRFLTGPPRPPSPAPSPSPGPPRPADSLANGRSSKRRP
SRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRDLVPDRLFVFFNWLGYANSA
FNPIIYCRSPDFRKAFQRLLCCARRAACRRRAAHGDRPRASGCLARAGPPPSPGAPSDDD
DDDAGATPPARLLEPWAGCNGGTTTVDSDSSLDEPGRQGFSSESKV
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Component 2 |
Name: | Beta-2 adrenergic receptor |
Synonyms: | ADRB2_RAT | Adrb2 | Adrb2r | Adrenergic receptor beta |
Type: | PROTEIN |
Mol. Mass.: | 46896.26 |
Organism: | Rattus norvegicus |
Description: | ChEMBL_38603 |
Residue: | 418 |
Sequence: | MEPHGNDSDFLLAPNGSRAPGHDITQERDEAWVVGMAILMSVIVLAIVFGNVLVITAIAK
FERLQTVTNYFITSLACADLVMGLAVVPFGASHILMKMWNFGNFWCEFWTSIDVLCVTAS
IETLCVIAVDRYVAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHKQ
AIDCYAKETCCDFFTNQAYAIASSIVSFYVPLVVMVFVYSRVFQVAKRQLQKIDKSEGRF
HAQNLSQVEQDGRSGHGLRSSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIRA
NLIPKEVYILLNWLGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSSKTYGNGYSSNSNG
RTDYTGEQSAYQLGQEKENELLCEEAPGMEGFVNCQGTVPSLSIDSQGRNCNTNDSPL
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Component 3 |
Name: | Beta-3 adrenergic receptor |
Synonyms: | ADRB3_RAT | Adrb3 | Adrb3r | Adrenergic receptor beta | Beta-3 adrenergic receptor |
Type: | PROTEIN |
Mol. Mass.: | 43161.83 |
Organism: | Rattus norvegicus |
Description: | ChEMBL_1509452 |
Residue: | 400 |
Sequence: | MAPWPHKNGSLAFWSDAPTLDPSAANTSGLPGVPWAAALAGALLALATVGGNLLVITAIA
RTPRLQTITNVFVTSLATADLVVGLLVMPPGATLALTGHWPLGATGCELWTSVDVLCVTA
SIETLCALAVDRYLAVTNPLRYGTLVTKRRARAAVVLVWIVSATVSFAPIMSQWWRVGAD
AEAQECHSNPRCCSFASNMPYALLSSSVSFYLPLLVMLFVYARVFVVAKRQRRLLRRELG
RFPPEESPRSPSRSPSPATVGTPTASDGVPSCGRRPARLLPLGEHRALRTLGLIMGIFSL
CWLPFFLANVLRALVGPSLVPSGVFIALNWLGYANSAFNPLIYCRSPDFRDAFRRLLCSY
GGRGPEEPRVVTFPASPVASRQNSPLNRFDGYEGERPFPT
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BDBM50019061 |
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n/a |
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Name | BDBM50019061 |
Synonyms: | (+/-)4-(2-Amino-1-hydroxy-ethyl)-5-fluoro-benzene-1,2-diol | 4-(2-Amino-1-hydroxy-ethyl)-5-fluoro-benzene-1,2-diol | 4-(2-Amino-1-hydroxy-ethyl)-5-fluoro-benzene-1,2-diol(6-FNE) | CHEMBL281232 |
Type | Small organic molecule |
Emp. Form. | C8H10FNO3 |
Mol. Mass. | 187.1683 |
SMILES | NCC(O)c1cc(O)c(O)cc1F |
Structure |
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