Reaction Details Report a problem with these data
Target
Glucagon receptor
Ligand
BDBM50324710
Substrate
n/a
Meas. Tech.
ChEMBL_651179 (CHEMBL1227944)
EC50
0.13±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:
BDBM50324710
Synonyms:
CHEMBL1222084
Type:
Small organic molecule
Emp. Form.:
C154H227N43O49S
Mol. Mass.:
3496.774
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](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@@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:203.211,175.188,165.172,145.158,130.139,110.117,98.101,223.231,76.86,62.70,43.53,30.37,8.12,232.238,wD:194.205,186.192,217.225,171.176,220.228,157.166,139.145,118.130,102.109,87.97,71.74,54.61,39.41,16.28,4.4,240.246,241.249,207.212,(49.77,-5.31,;48.46,-4.51,;48.46,-2.92,;47.15,-2.13,;47.15,-.53,;45.84,.27,;44.54,-.53,;44.54,-2.12,;43.22,.27,;43.22,1.86,;44.54,2.66,;44.54,4.25,;45.85,1.86,;41.91,-.53,;40.59,.27,;40.59,1.86,;39.29,-.52,;39.29,-2.12,;40.59,-2.91,;41.98,-2.27,;43,-3.45,;42.23,-4.84,;42.67,-6.28,;41.64,-7.38,;40.16,-7.04,;39.72,-5.59,;40.75,-4.49,;37.98,.28,;36.66,-.52,;36.66,-2.12,;35.35,.28,;35.35,1.87,;36.66,2.67,;36.66,4.26,;35.36,5.05,;37.98,5.05,;34.04,-.52,;32.74,.28,;32.74,1.87,;31.42,-.52,;30.11,.29,;28.8,-.51,;28.8,-2.11,;27.47,.29,;27.47,1.88,;28.8,2.68,;30.11,1.87,;31.42,2.67,;31.42,4.26,;30.11,5.06,;28.8,4.27,;26.18,-.51,;24.86,.29,;24.86,1.88,;23.55,-.51,;23.55,-2.1,;24.86,-2.89,;26.17,-2.1,;24.86,-4.48,;22.24,.3,;20.92,-.5,;20.92,-2.1,;19.61,.3,;19.61,1.89,;20.92,2.69,;20.92,4.28,;19.62,5.07,;22.25,5.07,;18.3,-.5,;16.99,.3,;16.99,1.89,;15.68,-.5,;15.68,-2.09,;14.38,.3,;13.06,-.49,;13.06,-2.09,;11.75,.31,;11.75,1.9,;13.06,2.7,;13.06,4.28,;14.38,5.08,;14.38,6.67,;13.07,7.46,;15.68,7.47,;10.44,-.48,;9.12,.31,;9.12,1.91,;7.81,-.48,;7.81,-2.03,;9.16,-2.81,;9.16,-4.36,;10.5,-5.14,;10.5,-6.69,;11.84,-7.47,;9.15,-7.47,;6.49,.32,;5.2,-.47,;5.2,-2.08,;3.87,.32,;2.58,-.47,;1.26,.33,;1.26,1.92,;-.06,-.46,;-.06,-2.06,;1.26,-2.85,;2.56,-2.06,;1.26,-4.45,;-1.37,.33,;-2.68,-.46,;-2.68,-2.06,;-3.99,.33,;-3.99,1.92,;-2.68,2.72,;-2.68,4.31,;-1.35,1.92,;-5.29,-.46,;-6.61,.34,;-6.61,1.93,;-7.91,-.45,;-7.91,-2.06,;-6.61,-2.85,;-5.3,-2.06,;-3.99,-2.85,;-3.99,-4.44,;-2.67,-5.24,;-5.3,-5.24,;-6.61,-4.44,;-9.23,.34,;-10.55,-.45,;-10.55,-2.05,;-11.85,.34,;-11.85,1.93,;-10.55,2.73,;-10.55,4.32,;-9.24,5.12,;-9.24,6.71,;-13.17,-.45,;-14.47,.35,;-14.47,1.93,;-15.78,-.44,;-15.78,-2.05,;-14.47,-2.84,;-17.11,.35,;-18.41,-.44,;-18.41,-2.04,;-19.71,.35,;-19.71,1.94,;-18.41,2.74,;-17.1,1.94,;-15.78,2.74,;-15.78,4.33,;-14.47,5.13,;-17.1,5.13,;-18.41,4.33,;-21.03,-.44,;-22.34,.36,;-22.34,1.94,;-23.66,-.43,;-23.66,-2.03,;-22.34,-2.83,;-21.05,-2.03,;-22.34,-4.42,;-24.96,.36,;-26.28,-.43,;-26.28,-2.03,;-27.59,.36,;-27.59,1.95,;-26.28,2.75,;-28.89,-.43,;-30.23,.36,;-30.23,1.95,;-31.51,-.43,;-32.84,.37,;-34.14,-.42,;-34.14,-2.02,;-35.46,.37,;-35.46,1.96,;-34.14,2.76,;-32.84,1.96,;-31.52,2.75,;-31.52,4.34,;-32.83,5.15,;-34.13,4.35,;-36.76,-.42,;-38.08,.37,;-38.08,1.96,;-39.39,-.42,;-40.7,.38,;-42.01,-.41,;-42.01,-2.01,;-43.31,.38,;-44.64,-.41,;-45.95,.38,;-45.95,1.97,;-47.26,-.41,;-47.26,-2,;-45.94,-2.8,;-45.94,-4.39,;-47.25,-5.19,;-44.65,-5.19,;-48.57,.38,;-49.88,-.41,;-49.88,-2,;-51.2,.38,;-51.2,1.98,;-49.86,2.78,;-52.49,-.41,;-53.85,.37,;-53.85,1.9,;-55.17,2.67,;-56.43,1.8,;-57.67,2.73,;-57.17,4.19,;-55.62,4.16,;-55.19,-.41,;-56.52,.37,;-55.19,-1.96,;-39.39,-2.01,;-40.7,-2.81,;-38.08,-2.81,;-31.51,-2.02,;-32.84,-2.82,;-30.23,-2.82,;3.87,1.91,;2.53,2.67,;5.2,2.71,;31.42,-2.11,;32.74,-2.9,;30.11,-2.9,;48.46,.26,;48.46,1.85,;49.79,-.54,;51.08,.26,;51.08,1.85,;52.4,2.65,;53.71,1.85,;52.4,4.24,;52.4,-.54,;52.4,-2.13,;53.71,.26,;55.02,-.54,;55.02,-2.14,;53.71,-2.93,;56.33,-2.93,;56.33,.26,;57.67,-.5,;56.33,1.84,)|
Structure:
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