Reaction Details Report a problem with these data
Target
Alpha-1A adrenergic receptor
Ligand
BDBM50160163
Substrate
n/a
Meas. Tech.
ChEMBL_303162 (CHEMBL829974)
Ki
490±n/a nM
Citation
 Li, MY; Tsai, KC; Xia, L Pharmacophore identification of alpha(1A)-adrenoceptor antagonists. Bioorg Med Chem Lett 15:657-64 (2005) [PubMed]  Article 
Target
Name:
Alpha-1A adrenergic receptor
Synonyms:
ADA1A_HUMAN | ADRA1A | ADRA1C | Adrenergic alpha1A | Alpha 1A-adrenoceptor | Alpha 1A-adrenoreceptor | Alpha adrenergic receptor 1a | Alpha-1C adrenergic receptor | Alpha-adrenergic receptor 1c | Cerebral cortex alpha adrenergic receptor | adrenergic Alpha1 | adrenergic Alpha1C
Type:
Cell-surface receptors
Mol. Mass.:
51511.67
Organism:
Homo sapiens (Human)
Description:
P35348
Residue:
466
Sequence:
MVFLSGNASDSSNCTQPPAPVNISKAILLGVILGGLILFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEVLGYWAFGRVFCNIWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQRRGLMALLCVWALSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYLPLAIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNAPAGGSGMASAKTKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFKPSETVFKIVFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLCRKQSSKHALGYTLHPPSQAVEGQHKDMVRIPVGSRETFYRISKTDGVCEWKFFSSMPRGSARITVSKDQSSCTTARVRSKSFLQVCCCVGPSTPSLDKNHQVPTIKVHTISLSENGEEV
  
Inhibitor
Name:
BDBM50160163
Synonyms:
A-315456 | CHEMBL362863 | Ethanesulfonic acid {3-[cyclohexylidene-(1H-imidazol-4-yl)-methyl]-phenyl}-amide
Type:
Small organic molecule
Emp. Form.:
C18H23N3O2S
Mol. Mass.:
345.459
SMILES:
CCS(=O)(=O)Nc1cccc(c1)C(c1cnc[nH]1)=C1CCCCC1 |(-7.48,.25,;-6.41,-.85,;-4.9,-.45,;-4.3,-1.88,;-5.47,.97,;-3.57,.32,;-2.22,-.44,;-2.22,-2,;-.89,-2.77,;.44,-2,;.44,-.44,;-.89,.32,;1.78,.34,;1.78,1.89,;.52,2.77,;1.01,4.25,;2.53,4.25,;3.02,2.8,;3.12,-.43,;3.12,-1.97,;4.45,-2.74,;5.78,-1.97,;5.78,-.43,;4.44,.34,)|
Structure:
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