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Target
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor
Ligand
BDBM50272483
Substrate
n/a
Meas. Tech.
ChEMBL_1712279 (CHEMBL4122328)
IC50
1870±n/a nM
Citation
 Kubacka, M; Szkaradek, N; Mogilski, S; Pańczyk, K; Siwek, A; Gryboś, A; Filipek, B; Żmudzki, P; Marona, H; Waszkielewicz, AM Design, synthesis and cardiovascular evaluation of some aminoisopropanoloxy derivatives of xanthone. Bioorg Med Chem 26:3773-3784 (2018) [PubMed]  Article 
Target
Name:
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor
Synonyms:
Adrenergic receptor alpha-1 | alpha-1 Adrenergic Receptor | Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
Type:
n/a
Mol. Mass.:
n/a
Description:
ASSAY_ID of EBI is 303470
Components:
This complex has 3 components.
Component 1
Name:
Alpha-1B adrenergic receptor
Synonyms:
Alpha-1Adrenoceptor | Alpha-1B adrenergic receptor | Alpha 1B-adrenoceptor | Alpha-1B adrenoreceptor | adrenergic Alpha1B | Alpha 1B-adrenoreceptor | Alpha-1 Adrenergic Receptor | ADA1B_RAT | Adra1b | Alpha adrenergic receptor 1A and 1B
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
56606.71
Organism:
Rat
Description:
Receptor binding assays were performed using rat cortical membranes.
Residue:
515
Sequence:
MNPDLDTGHNTSAPAHWGELKDDNFTGPNQTSSNSTLPQLDVTRAISVGLVLGAFILFAIVGNILVILSVACNRHLRTPTNYFIVNLAIADLLLSFTVLPFSATLEVLGYWVLGRIFCDIWAAVDVLCCTASILSLCAISIDRYIGVRYSLQYPTLVTRRKAILALLSVWVLSTVISIGPLLGWKEPAPNDDKECGVTEEPFYALFSSLGSFYIPLAVILVMYCRVYIVAKRTTKNLEAGVMKEMSNSKELTLRIHSKNFHEDTLSSTKAKGHNPRSSIAVKLFKFSREKKAAKTLGIVVGMFILCWLPFFIALPLGSLFSTLKPPDAVFKVVFWLGYFNSCLNPIIYPCSSKEFKRAFMRILGCQCRGGRRRRRRRRLGACAYTYRPWTRGGSLERSQSRKDSLDDSGSCMSGTQRTLPSASPSPGYLGRGTQPPVELCAFPEWKPGALLSLPEPPGRRGRLDSGPLFTFKLLGDPESPGTEGDTSNGGCDTTTDLANGQPGFKSNMPLAPGHF
  
Component 2
Name:
Alpha-1A adrenergic receptor
Synonyms:
Alpha-1A adrenoreceptor | Alpha-1 adrenoreceptor | adrenergic Alpha1A | Alpha-1A adrenoceptor | Alpha-1C adrenergic receptor | ADA1A_RAT | Adra1a | Adra1c
Type:
Protein
Mol. Mass.:
51620.15
Organism:
Rat
Description:
P43140
Residue:
466
Sequence:
MVLLSENASEGSNCTHPPAPVNISKAILLGVILGGLIIFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEILGYWAFGRVFCNIWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQRRGVRALLCVWVLSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYVPLAIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNVPAEGGGVSSAKNKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFKPSETVFKIVFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLRRRQSSKHALGYTLHPPSQALEGQHRDMVRIPVGSGETFYKISKTDGVCEWKFFSSMPQGSARITVPKDQSACTTARVRSKSFLQVCCCVGSSAPRPEENHQVPTIKIHTISLGENGEEV
  
Component 3
Name:
Alpha-1D adrenergic receptor
Synonyms:
Serotonin 1a (5-HT1a) receptor/Adrenergic receptor alpha-1 | Alpha adrenergic receptor 1A and 1D | ADA1D_RAT | Adra1d | Adra1a | Alpha-1D adrenergic receptor
Type:
Protein
Mol. Mass.:
59375.97
Organism:
Rat
Description:
P23944
Residue:
561
Sequence:
MTFRDILSVTFEGPRSSSSTGGSGAGGGAGTVGPEGGAVGGVPGATGGGAVVGTGSGEDNQSSTGEPGAAASGEVNGSAAVGGLVVSAQGVGVGVFLAAFILTAVAGNLLVILSVACNRHLQTVTNYFIVNLAVADLLLSAAVLPFSATMEVLGFWAFGRTFCDVWAAVDVLCCTASILSLCTISVDRYVGVRHSLKYPAIMTERKAAAILALLWAVALVVSVGPLLGWKEPVPPDERFCGITEEVGYAIFSSVCSFYLPMAVIVVMYCRVYVVARSTTRSLEAGIKREPGKASEVVLRIHCRGAATSAKGYPGTQSSKGHTLRSSLSVRLLKFSREKKAAKTLAIVVGVFVLCWFPFFFVLPLGSLFPQLKPSEGVFKVIFWLGYFNSCVNPLIYPCSSREFKRAFLRLLRCQCRRRRRRLWAVYGHHWRASTGDARSDCAPSPRIAPPGAPLALTAHPGAGSADTPETQDSVSSSRKPASALREWRLLGPLQRPTTQLRAKVSSLSHKIRSGARRAETACALRSEVEAVSLNVPQDGAEAVICQAYEPGDYSNLRETDI
  
Inhibitor
Name:
BDBM50272483
Synonyms:
CHEMBL4128794
Type:
Small organic molecule
Emp. Form.:
C24H24ClNO5
Mol. Mass.:
441.91
SMILES:
COc1ccccc1CNCC(O)COc1cccc2c1oc1ccccc1c2=O
Structure:
Search PDB for entries with ligand similarity: