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Target
5'-AMP-activated protein kinase catalytic subunit alpha-1
Ligand
BDBM192513
Substrate
n/a
Meas. Tech.
AMPK Activation Assay
pH
7±n/a
EC50
17±n/a nM
Citation
 Wagner, H; Himmelsbach, F Azabenzimidazole derivatives US Patent  US9187477 Publication Date 11/17/2015 
Target
Name:
5'-AMP-activated protein kinase catalytic subunit alpha-1
Synonyms:
AAPK1_HUMAN | ACACA kinase | AMP-activated protein kinase alpha-1/beta-2/gamma-2 | AMP-activated protein kinase, alpha-1 subunit | AMPK subunit alpha-1 | AMPK-alpha1 | AMPK1 | Hydroxymethylglutaryl-CoA reductase kinase | PRKAA1 | Tau-protein kinase PRKAA1
Type:
Protein
Mol. Mass.:
64023.62
Organism:
Homo sapiens (Human)
Description:
Q13131
Residue:
559
Sequence:
MRRLSSWRKMATAEKQKHDGRVKIGHYILGDTLGVGTFGKVKVGKHELTGHKVAVKILNRQKIRSLDVVGKIRREIQNLKLFRHPHIIKLYQVISTPSDIFMVMEYVSGGELFDYICKNGRLDEKESRRLFQQILSGVDYCHRHMVVHRDLKPENVLLDAHMNAKIADFGLSNMMSDGEFLRTSCGSPNYAAPEVISGRLYAGPEVDIWSSGVILYALLCGTLPFDDDHVPTLFKKICDGIFYTPQYLNPSVISLLKHMLQVDPMKRATIKDIREHEWFKQDLPKYLFPEDPSYSSTMIDDEALKEVCEKFECSEEEVLSCLYNRNHQDPLAVAYHLIIDNRRIMNEAKDFYLATSPPDSFLDDHHLTRPHPERVPFLVAETPRARHTLDELNPQKSKHQGVRKAKWHLGIRSQSRPNDIMAEVCRAIKQLDYEWKVVNPYYLRVRRKNPVTSTYSKMSLQLYQVDSRTYLLDFRSIDDEITEAKSGTATPQRSGSVSNYRSCQRSDSDAEAQGKSSEVSLTSSVTSLDSSPVDLTPRPGSHTIEFFEMCANLIKILAQ
  
Inhibitor
Name:
BDBM192513
Synonyms:
US9187477, 9
Type:
Small organic molecule
Emp. Form.:
C29H33ClN4O6
Mol. Mass.:
569.049
SMILES:
O[C@@H]1COC2[C@@H](COC12)Oc1nc2cc(Cl)c(nc2[nH]1)-c1ccc(cc1)[C@H]1CC[C@@H](CC1)OC(=O)N1CCCC1 |r,wU:26.30,5.10,1.0,wD:29.37,(12.88,-6.05,;12.11,-4.72,;12.58,-3.25,;11.34,-2.35,;10.09,-3.25,;8.55,-3.25,;8.08,-4.72,;9.32,-5.62,;10.57,-4.72,;7.78,-1.92,;6.24,-1.92,;5.34,-3.17,;3.87,-2.69,;2.54,-3.46,;1.21,-2.69,;-.13,-3.46,;1.21,-1.15,;2.54,-.38,;3.87,-1.15,;5.34,-.67,;-.13,-.38,;-.13,1.16,;-1.46,1.93,;-2.8,1.16,;-2.8,-.38,;-1.46,-1.15,;-3.84,1.88,;-5.17,1.11,;-6.51,1.88,;-6.51,3.42,;-5.17,4.19,;-3.84,3.42,;-7.84,4.19,;-9.18,3.42,;-9.18,1.88,;-10.51,4.19,;-10.51,5.73,;-11.97,6.21,;-12.88,4.96,;-11.97,3.71,)|
Structure:
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