Reaction Details Report a problem with these data
Target
Alpha-2A adrenergic receptor
Ligand
BDBM50013515
Substrate
n/a
Meas. Tech.
ChEMBL_2425316
Kd
4.8±n/a nM
Citation
 Chayka, A; Česnek, M; Kužmová, E; Kozák, J; Tloušt'ová, E; Dvořáková, A; Strmeň, T; Brož, B; Osifová, Z; Dračínský, M; Mertlíková-Kaiserová, H; Janeba, Z Structure-Based Drug Design of ADRA2A Antagonists Derived from Yohimbine. J Med Chem 67:10135-10151[PubMed] 
Target
Name:
Alpha-2A adrenergic receptor
Synonyms:
ADRA2R | Adrenergic receptor alpha | ADRA2A | Adrenergic alpha2A | Alpha-2 adrenergic receptor subtype C10 | alpha-2A adrenergic receptor [Homo sapiens] | ADRAR | ADA2A_HUMAN | Alpha-2AAR | Alpha-2A adrenoceptor | Alpha-2A adrenoreceptor
Type:
Enzyme
Mol. Mass.:
48979.91
Organism:
Human
Description:
P08913
Residue:
465
Sequence:
MFRQEQPLAEGSFAPMGSLQPDAGNASWNGTEAPGGGARATPYSLQVTLTLVCLAGLLMLLTVFGNVLVIIAVFTSRALKAPQNLFLVSLASADILVATLVIPFSLANEVMGYWYFGKAWCEIYLALDVLFCTSSIVHLCAISLDRYWSITQAIEYNLKRTPRRIKAIIITVWVISAVISFPPLISIEKKGGGGGPQPAEPRCEINDQKWYVISSCIGSFFAPCLIMILVYVRIYQIAKRRTRVPPSRRGPDAVAAPPGGTERRPNGLGPERSAGPGGAEAEPLPTQLNGAPGEPAPAGPRDTDALDLEESSSSDHAERPPGPRRPERGPRGKGKARASQVKPGDSLPRRGPGATGIGTPAAGPGEERVGAAKASRWRGRQNREKRFTFVLAVVIGVFVVCWFPFFFTYTLTAVGCSVPRTLFKFFFWFGYCNSSLNPVIYTIFNHDFRRAFKKILCRGDRKRIV
  
Inhibitor
Name:
BDBM50013515
Synonyms:
yohimbic acid methyl ester | 17alpha-hydroxyyohimban-16alpha-carboxylic acid methyl ester | CORYNANTHINE | Johimbin | Yohimbine | cid_8969 | (16alpha,17alpha)-17-hydroxyyohimban-16-carboxylic acid methyl ester | Quebrachin | Yohimbin | YOHIMBINE CHLORIDE | CHEMBL15245 | (+)-yohimbine | aphrodine | corynine | quebrachine | RAUWOLSCINE | methyl 17alpha-hydroxyyohimban-16alpha-carboxylate
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r|
Structure:
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