Reaction Details Report a problem with these data
Target
Glucagon receptor
Ligand
BDBM50324723
Substrate
n/a
Meas. Tech.
ChEMBL_651179 (CHEMBL1227944)
EC50
0.12±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:
BDBM50324723
Synonyms:
CHEMBL1222097
Type:
Small organic molecule
Emp. Form.:
C154H229N43O48S
Mol. Mass.:
3482.79
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](CCCCN)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](CO)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:205.213,177.190,167.174,147.160,132.141,112.119,98.103,76.86,62.70,43.53,30.37,8.12,231.237,wD:196.207,188.194,219.227,173.178,222.230,159.168,141.147,120.132,104.111,87.97,71.74,54.61,39.41,16.28,4.4,239.245,240.248,209.214,(49.71,-5.2,;48.4,-4.41,;48.4,-2.82,;47.1,-2.03,;47.1,-.44,;45.79,.36,;44.49,-.43,;44.49,-2.02,;43.17,.37,;43.17,1.95,;44.49,2.75,;44.49,4.34,;45.79,1.95,;41.87,-.43,;40.55,.37,;40.55,1.95,;39.25,-.43,;39.25,-2.02,;40.55,-2.81,;41.93,-2.17,;42.95,-3.35,;42.18,-4.73,;42.65,-6.24,;41.63,-7.42,;40.16,-7.08,;39.69,-5.57,;40.7,-4.39,;37.94,.37,;36.63,-.42,;36.63,-2.02,;35.32,.38,;35.32,1.96,;36.63,2.76,;36.63,4.35,;35.32,5.13,;37.94,5.14,;34.01,-.42,;32.71,.38,;32.71,1.96,;31.39,-.42,;30.08,.38,;28.78,-.42,;28.78,-2.01,;27.46,.38,;27.46,1.97,;28.78,2.77,;30.08,1.97,;31.39,2.76,;31.39,4.35,;30.09,5.14,;28.78,4.35,;26.17,-.41,;24.84,.39,;24.84,1.97,;23.55,-.41,;23.55,-2,;24.84,-2.79,;26.2,-2.05,;24.81,-4.34,;22.23,.39,;20.93,-.41,;20.93,-2,;19.61,.39,;19.61,1.98,;20.95,2.75,;20.95,4.3,;22.29,5.08,;22.29,6.63,;18.3,-.4,;17,.4,;17,1.98,;15.69,-.4,;15.69,-1.99,;14.39,.4,;13.07,-.39,;13.07,-1.99,;11.76,.4,;11.76,1.99,;13.07,2.8,;13.07,4.37,;14.39,5.16,;14.39,6.76,;13.07,7.55,;15.69,7.55,;10.46,-.39,;9.13,.41,;9.13,2,;7.82,-.38,;7.82,-1.98,;9.13,-2.77,;9.13,-4.36,;10.45,-5.16,;10.45,-6.75,;9.12,-7.55,;11.76,-7.55,;6.51,.42,;5.22,-.37,;5.22,-1.98,;3.9,.42,;3.9,2.01,;5.22,2.8,;2.6,-.37,;1.29,.42,;1.29,2.01,;-.03,-.37,;-.03,-1.96,;1.29,-2.75,;2.58,-1.96,;1.29,-4.35,;-1.33,.43,;-2.64,-.36,;-2.64,-1.96,;-3.96,.43,;-3.96,2.01,;-2.64,2.81,;-2.64,4.4,;-1.32,2.01,;-5.25,-.36,;-6.57,.43,;-6.57,2.02,;-7.87,-.36,;-7.87,-1.96,;-6.57,-2.74,;-5.26,-1.96,;-3.96,-2.75,;-3.95,-4.34,;-2.64,-5.14,;-5.26,-5.14,;-6.57,-4.34,;-9.19,.44,;-10.5,-.35,;-10.5,-1.95,;-11.8,.44,;-11.8,2.02,;-10.5,2.82,;-10.5,4.41,;-9.19,5.21,;-9.19,6.79,;-13.11,-.35,;-14.42,.44,;-14.42,2.03,;-15.72,-.35,;-15.72,-1.95,;-14.42,-2.74,;-17.05,.44,;-18.34,-.34,;-18.34,-1.94,;-19.65,.45,;-19.65,2.03,;-18.34,2.83,;-17.04,2.03,;-15.72,2.83,;-15.72,4.41,;-14.41,5.21,;-17.04,5.21,;-18.35,4.42,;-20.97,-.34,;-22.27,.45,;-22.27,2.04,;-23.59,-.34,;-23.59,-1.93,;-22.27,-2.73,;-20.98,-1.93,;-22.27,-4.32,;-24.89,.45,;-26.2,-.33,;-26.2,-1.93,;-27.51,.46,;-27.51,2.04,;-26.2,2.84,;-28.81,-.33,;-30.14,.46,;-30.14,2.04,;-31.43,-.33,;-32.75,.46,;-34.05,-.33,;-34.05,-1.92,;-35.36,.47,;-35.36,2.05,;-34.05,2.85,;-32.75,2.05,;-31.43,2.84,;-31.43,4.43,;-32.74,5.23,;-34.04,4.44,;-36.66,-.32,;-37.98,.47,;-37.98,2.05,;-39.29,-.32,;-40.6,.47,;-41.9,-.32,;-41.9,-1.91,;-43.2,.47,;-44.53,-.31,;-45.83,.48,;-45.83,2.06,;-47.14,-.31,;-47.14,-1.9,;-45.83,-2.7,;-45.83,-4.29,;-47.14,-5.09,;-44.54,-5.09,;-48.45,.48,;-49.75,-.31,;-49.75,-1.9,;-51.08,.48,;-51.08,2.07,;-49.74,2.87,;-52.37,-.3,;-53.72,.48,;-53.72,2.02,;-55.06,2.8,;-56.32,1.92,;-57.57,2.86,;-57.06,4.34,;-55.49,4.31,;-55.06,-.3,;-56.41,.48,;-55.06,-1.86,;-39.29,-1.91,;-40.6,-2.71,;-37.98,-2.71,;-31.43,-1.92,;-32.75,-2.72,;-30.14,-2.72,;31.39,-2.01,;32.71,-2.8,;30.08,-2.8,;48.4,.36,;48.4,1.95,;49.72,-.44,;51.02,.36,;51.02,1.94,;52.34,2.74,;53.64,1.94,;52.34,4.33,;52.34,-.44,;52.34,-2.03,;53.64,.35,;54.95,-.45,;54.95,-2.04,;53.64,-2.83,;56.26,-2.83,;56.26,.35,;57.57,-.45,;56.26,1.94,)|
Structure:
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