Reaction Details Report a problem with these data
Target
Glucagon-like peptide 1 receptor
Ligand
BDBM50261519
Substrate
n/a
Meas. Tech.
ChEMBL_533247 (CHEMBL972349)
EC50
0.008000±n/a nM
Citation
 Miranda, LP; Winters, KA; Gegg, CV; Patel, A; Aral, J; Long, J; Zhang, J; Diamond, S; Guido, M; Stanislaus, S; Ma, M; Li, H; Rose, MJ; Poppe, L; Véniant, MM Design and synthesis of conformationally constrained glucagon-like peptide-1 derivatives with increased plasma stability and prolonged in vivo activity. J Med Chem 51:2758-65 (2008) [PubMed]  Article 
Target
Name:
Glucagon-like peptide 1 receptor
Synonyms:
GLP-1 receptor | GLP-1-R | GLP-1R | GLP1R | GLP1R_HUMAN | Glucagon-like peptide 1 receptor | Glucagon-like peptide 1 receptor (GLP-1)
Type:
Enzyme
Mol. Mass.:
53035.78
Organism:
Homo sapiens (Human)
Description:
P43220
Residue:
463
Sequence:
MAGAPGPLRLALLLLGMVGRAGPRPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLYIIYTVGYALSFSALVIASAILLGFRHLHCTRNYIHLNLFASFILRALSVFIKDAALKWMYSTAAQQHQWDGLLSYQDSLSCRLVFLLMQYCVAANYYWLLVEGVYLYTLLAFSVLSEQWIFRLYVSIGWGVPLLFVVPWGIVKYLYEDEGCWTRNSNMNYWLIIRLPILFAIGVNFLIFVRVICIVVSKLKANLMCKTDIKCRLAKSTLTLIPLLGTHEVIFAFVMDEHARGTLRFIKLFTELSFTSFQGLMVAILYCFVNNEVQLEFRKSWERWRLEHLHIQRDSSMKPLKCPTSSLSSGATAGSSMYTATCQASCS
  
Inhibitor
Name:
BDBM50261519
Synonyms:
CHEMBL527077 | c[Glu22-Lys26][Gly8]GLP-1(7-37)-NH2
Type:
Small organic molecule
Emp. Form.:
C153H229N41O47
Mol. Mass.:
3394.7019
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)[C@@H](N)Cc2cnc[nH]2)[C@H](C)O)[C@H](C)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O |r,wU:105.115,148.153,95.99,83.85,71.75,42.48,157.161,166.170,8.16,2.2,179.184,198.204,213.219,145.150,wD:137.140,124.132,116.119,101.103,87.93,77.81,59.69,51.56,38.39,171.175,28.28,19.25,4.4,184.188,206.212,226.232,(21.01,-.2,;19.67,-.94,;18.34,-.15,;18.36,1.39,;16.99,-.9,;16.96,-2.45,;18.28,-3.24,;19.63,-2.48,;18.26,-4.79,;16.92,-5.54,;15.58,-4.74,;15.62,-3.18,;14.3,-2.4,;12.95,-3.15,;12.93,-4.68,;14.24,-5.48,;19.57,-5.57,;19.55,-7.12,;18.21,-7.87,;20.87,-7.91,;22.22,-7.16,;22.24,-5.62,;23.59,-4.87,;24.92,-5.66,;23.62,-3.34,;20.84,-9.46,;22.16,-10.25,;23.51,-9.49,;22.14,-11.79,;23.41,-10.93,;24.8,-11.61,;26.07,-10.75,;25.96,-9.22,;32.17,-22.62,;31.84,-24.11,;30.36,-24.58,;30.03,-26.07,;28.56,-26.54,;27.23,-25.74,;25.88,-26.5,;25.86,-28.03,;27.19,-28.83,;24.51,-28.79,;23.19,-28,;21.85,-28.75,;20.52,-27.96,;20.54,-26.41,;19.17,-28.7,;24.48,-30.32,;23.12,-31.08,;21.81,-30.29,;23.11,-32.61,;24.44,-33.4,;25.78,-32.66,;27.11,-33.46,;25.8,-31.12,;21.75,-33.37,;21.73,-34.9,;23.06,-35.69,;20.39,-35.64,;20.37,-37.19,;21.69,-37.98,;21.65,-39.52,;22.98,-40.31,;24.32,-39.56,;25.65,-40.35,;24.34,-38.02,;23.03,-37.22,;19.06,-34.85,;17.73,-35.58,;17.7,-37.14,;16.4,-34.79,;16.41,-33.27,;17.77,-32.51,;15.05,-35.54,;13.72,-34.74,;13.74,-33.22,;12.38,-35.49,;12.36,-37.05,;13.68,-37.83,;11.05,-34.7,;9.71,-35.47,;9.69,-37.01,;8.38,-34.66,;7.04,-35.41,;5.71,-34.62,;5.73,-33.09,;4.37,-35.37,;4.34,-36.91,;5.66,-37.7,;7,-36.95,;5.64,-39.25,;3.04,-34.57,;1.7,-35.31,;1.68,-36.86,;.37,-34.52,;.39,-32.99,;1.75,-32.23,;-.97,-35.28,;-2.3,-34.48,;-2.27,-32.94,;-3.64,-35.23,;-4.97,-34.43,;-6.31,-35.17,;-6.32,-36.72,;-7.64,-34.37,;-7.61,-32.85,;-6.25,-32.1,;-4.93,-32.89,;-3.6,-32.14,;-3.58,-30.6,;-4.9,-29.81,;-6.23,-30.55,;-8.98,-35.12,;-10.3,-34.32,;-10.27,-32.8,;-11.64,-35.08,;-12.97,-34.29,;-14.32,-35.03,;-14.34,-36.58,;-15.66,-34.23,;-17,-34.98,;-18.32,-34.2,;-18.31,-32.64,;-19.66,-34.93,;-19.68,-36.47,;-18.37,-37.26,;-18.39,-38.82,;-19.73,-39.57,;-17.08,-39.59,;-20.99,-34.14,;-22.33,-34.89,;-22.36,-36.44,;-23.65,-34.1,;-25.01,-34.85,;-26.32,-34.06,;-26.3,-32.51,;-27.69,-34.81,;-29.01,-34.02,;-27.69,-36.35,;-26.39,-37.12,;-26.25,-38.66,;-24.73,-39.01,;-23.96,-37.71,;-24.96,-36.53,;-11.66,-36.63,;-13.02,-37.38,;-10.33,-37.42,;-3.66,-36.77,;-5.01,-37.51,;-2.34,-37.55,;8.4,-33.13,;9.76,-32.36,;7.09,-32.34,;27.26,-24.21,;28.61,-23.46,;25.94,-23.43,;25.96,-21.87,;24.64,-21.09,;23.31,-21.84,;23.28,-23.37,;24.59,-24.16,;21.93,-24.13,;27.32,-21.13,;28.64,-21.92,;27.34,-19.59,;26.02,-18.8,;24.68,-19.55,;26.05,-17.25,;27.4,-16.5,;24.73,-16.47,;24.75,-14.91,;26.11,-14.16,;23.43,-14.13,;22.09,-14.88,;23.46,-12.58,;15.67,-.11,;14.33,-.86,;15.69,1.43,;14.37,2.22,;13.04,1.47,;14.39,3.77,;15.75,4.53,;13.07,4.56,;13.1,6.11,;14.45,6.87,;14.48,8.41,;13.25,9.33,;13.75,10.78,;15.29,10.75,;16.34,11.88,;17.85,11.53,;18.3,10.06,;17.25,8.93,;15.74,9.3,;11.78,6.9,;10.44,6.15,;11.8,8.45,;10.5,9.23,;9.16,8.49,;7.82,9.29,;6.48,8.53,;7.84,10.83,;10.51,10.79,;9.21,11.58,;11.87,11.53,;11.9,13.07,;13.23,13.84,;13.27,15.36,;14.57,13.03,;10.58,13.86,;9.23,13.12,;10.6,15.41,;9.29,16.2,;7.95,15.44,;7.92,13.91,;6.57,13.16,;6.54,11.63,;5.19,10.86,;9.3,17.75,;7.99,18.54,;10.66,18.49,;10.69,20.03,;12.02,20.79,;13.37,19.99,;12.06,22.33,;13.41,23.09,;14.73,22.27,;16.07,23.04,;17.4,22.24,;18.74,23,;20.07,22.19,;20.05,20.64,;21.41,22.94,;13.43,24.6,;12.11,25.39,;14.78,25.36,;14.82,26.91,;16.17,27.64,;16.19,29.19,;17.48,26.86,)|
Structure:
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