Reaction Details Report a problem with these data
Target
Glucagon receptor
Ligand
BDBM50324704
Substrate
n/a
Meas. Tech.
ChEMBL_651179 (CHEMBL1227944)
EC50
0.1±n/a nM
Citation
 Day, JW; Ottaway, N; Patterson, JT; Gelfanov, V; Smiley, D; Gidda, J; Findeisen, H; Bruemmer, D; Drucker, DJ; Chaudhary, N; Holland, J; Hembree, J; Abplanalp, W; Grant, E; Ruehl, J; Wilson, H; Kirchner, H; Lockie, SH; Hofmann, S; Woods, SC; Nogueiras, R; Pfluger, PT; Perez-Tilve, D; DiMarchi, R; Tschöp, MH A new glucagon and GLP-1 co-agonist eliminates obesity in rodents. Nat Chem Biol 5:749-57 (2009) [PubMed]  Article 
Target
Name:
Glucagon receptor
Synonyms:
GCGR | GL-R | GLR_HUMAN | Glucagon Receptor (GCGR) | Glucagon receptor (GlucR)
Type:
Enzyme
Mol. Mass.:
54026.92
Organism:
Homo sapiens (Human)
Description:
P47871
Residue:
477
Sequence:
MPPCQPQRPLLLLLLLLACQPQVPSAQVMDFLFEKWKLYGDQCHHNLSLLPPPTELVCNRTFDKYSCWPDTPANTTANISCPWYLPWHHKVQHRFVFKRCGPDGQWVRGPRGQPWRDASQCQMDGEEIEVQKEVAKMYSSFQVMYTVGYSLSLGALLLALAILGGLSKLHCTRNAIHANLFASFVLKASSVLVIDGLLRTRYSQKIGDDLSVSTWLSDGAVAGCRVAAVFMQYGIVANYCWLLVEGLYLHNLLGLATLPERSFFSLYLGIGWGAPMLFVVPWAVVKCLFENVQCWTSNDNMGFWWILRFPVFLAILINFFIFVRIVQLLVAKLRARQMHHTDYKFRLAKSTLTLIPLLGVHEVVFAFVTDEHAQGTLRSAKLFFDLFLSSFQGLLVAVLYCFLNKEVQSELRRRWHRWRLGKVLWEERNTSNHRASSSPGHGPPSKELQFGRGGGSQDSSAETPLAGGLPRLAESPF
  
Inhibitor
Name:
BDBM50324704
Synonyms:
CHEMBL1222078
Type:
Small organic molecule
Emp. Form.:
C156H227N45O48S
Mol. Mass.:
3532.809
SMILES:
CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)N[C@@H](Cc1cnc[nH]1)C(O)=O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(N)=O |r,wU:209.218,181.195,171.179,151.165,136.146,116.124,98.108,76.86,62.70,43.53,30.37,8.12,235.242,wD:200.212,192.199,223.232,177.183,226.235,163.173,145.152,124.137,108.116,87.97,71.74,54.61,39.41,16.28,4.4,243.250,244.253,213.219,(49.7,-5.27,;48.4,-4.48,;48.4,-2.88,;47.09,-2.09,;47.09,-.5,;45.78,.29,;44.48,-.5,;44.48,-2.09,;43.16,.3,;43.16,1.88,;44.48,2.69,;44.48,4.27,;45.79,1.88,;41.86,-.49,;40.54,.3,;40.54,1.89,;39.24,-.49,;39.24,-2.08,;40.54,-2.88,;41.92,-2.23,;42.94,-3.42,;42.17,-4.8,;42.64,-6.3,;41.62,-7.48,;40.15,-7.15,;39.68,-5.64,;40.7,-4.46,;37.93,.3,;36.62,-.49,;36.62,-2.08,;35.31,.31,;35.31,1.89,;36.62,2.7,;36.62,4.28,;35.32,5.07,;37.94,5.07,;34,-.49,;32.7,.31,;32.7,1.9,;31.36,-.48,;30.06,.31,;28.77,-.48,;28.77,-2.07,;27.44,.32,;27.44,1.9,;28.77,2.7,;30.08,1.9,;31.38,2.7,;31.37,4.29,;30.07,5.07,;28.76,4.29,;26.15,-.48,;24.83,.32,;24.83,1.9,;23.53,-.47,;23.53,-2.06,;24.83,-2.86,;26.14,-2.06,;24.83,-4.45,;22.22,.32,;20.91,-.47,;20.91,-2.06,;19.59,.33,;19.59,1.91,;20.91,2.71,;20.88,4.25,;19.53,4.99,;22.2,5.06,;18.29,-.47,;16.98,.33,;16.98,1.91,;15.67,-.46,;15.67,-2.06,;14.37,.33,;13.05,-.45,;13.05,-2.05,;11.75,.33,;11.75,1.92,;13.05,2.73,;13.05,4.31,;14.37,5.1,;14.37,6.69,;13.06,7.48,;15.67,7.48,;10.44,-.45,;9.12,.34,;9.12,1.93,;7.81,-.45,;7.81,-1.99,;9.16,-2.76,;9.14,-4.3,;10.49,-5.07,;10.49,-6.62,;11.82,-7.39,;9.14,-7.39,;6.5,.35,;5.22,-.44,;5.22,-2.04,;3.89,.35,;3.9,1.93,;5.25,2.71,;5.22,4.26,;6.68,4.76,;7.63,3.52,;6.73,2.26,;2.59,-.43,;1.28,.35,;1.28,1.94,;-.04,-.43,;-.04,-2.03,;1.28,-2.82,;2.57,-2.03,;1.28,-4.41,;-1.35,.36,;-2.66,-.43,;-2.66,-2.03,;-3.97,.36,;-3.97,1.95,;-2.66,2.75,;-2.66,4.33,;-1.33,1.95,;-5.26,-.42,;-6.58,.36,;-6.58,1.95,;-7.88,-.42,;-7.88,-2.02,;-6.58,-2.81,;-5.27,-2.02,;-3.96,-2.82,;-3.96,-4.41,;-2.65,-5.2,;-5.27,-5.2,;-6.58,-4.4,;-9.2,.37,;-10.51,-.42,;-10.51,-2.02,;-11.82,.37,;-11.82,1.95,;-10.51,2.76,;-10.51,4.34,;-9.21,5.14,;-9.21,6.72,;-13.12,-.42,;-14.43,.37,;-14.43,1.96,;-15.73,-.41,;-15.73,-2.01,;-14.43,-2.8,;-17.06,.38,;-18.36,-.41,;-18.36,-2,;-19.66,.38,;-19.66,1.96,;-18.36,2.77,;-17.05,1.96,;-15.73,2.76,;-15.74,4.35,;-14.42,5.14,;-17.05,5.14,;-18.36,4.35,;-20.98,-.41,;-22.28,.38,;-22.28,1.97,;-23.6,-.4,;-23.6,-1.99,;-22.28,-2.79,;-20.99,-1.99,;-22.28,-4.39,;-24.9,.38,;-26.22,-.4,;-26.22,-1.99,;-27.52,.39,;-27.52,1.97,;-26.22,2.78,;-28.83,-.4,;-30.15,.39,;-30.15,1.98,;-31.44,-.39,;-32.76,.39,;-34.06,-.39,;-34.06,-1.98,;-35.38,.4,;-35.38,1.98,;-34.06,2.79,;-32.76,1.98,;-31.44,2.78,;-31.44,4.37,;-32.75,5.16,;-34.05,4.37,;-36.68,-.39,;-38,.4,;-38,1.99,;-39.3,-.38,;-40.61,.4,;-41.92,-.38,;-41.92,-1.97,;-43.21,.41,;-44.54,-.38,;-45.85,.41,;-45.85,1.99,;-47.15,-.38,;-47.15,-1.97,;-45.85,-2.77,;-45.85,-4.36,;-47.15,-5.15,;-44.55,-5.15,;-48.46,.41,;-49.77,-.38,;-49.77,-1.96,;-51.09,.41,;-51.09,2,;-49.75,2.8,;-52.38,-.38,;-53.73,.4,;-53.73,1.93,;-55.05,2.7,;-56.32,1.83,;-57.56,2.76,;-57.05,4.23,;-55.51,4.2,;-55.07,-.38,;-56.41,.4,;-55.07,-1.93,;-39.3,-1.98,;-40.61,-2.78,;-38,-2.78,;-31.44,-1.99,;-32.76,-2.79,;-30.15,-2.79,;31.36,-2.07,;32.7,-2.87,;30.06,-2.87,;48.4,.29,;48.4,1.88,;49.71,-.5,;51.01,.29,;51.01,1.87,;52.33,2.68,;53.64,1.87,;52.33,4.26,;52.33,-.51,;52.33,-2.1,;53.63,.29,;54.94,-.51,;54.94,-2.1,;53.63,-2.9,;56.25,-2.89,;56.25,.28,;57.56,-.52,;56.25,1.87,)|
Structure:
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