Reaction Details Report a problem with these data
Target
Glucagon-like peptide 1 receptor
Ligand
BDBM50393587
Substrate
n/a
Meas. Tech.
ChEMBL_855309 (CHEMBL2161793)
EC50
3334±n/a nM
Citation
 Liu, Q; Li, N; Yuan, Y; Lu, H; Wu, X; Zhou, C; He, M; Su, H; Zhang, M; Wang, J; Wang, B; Wang, Y; Ma, D; Ye, Y; Weiss, HC; Gesing, ER; Liao, J; Wang, MW Cyclobutane derivatives as novel nonpeptidic small molecule agonists of glucagon-like peptide-1 receptor. J Med Chem 55:250-67 (2012) [PubMed]  Article 
Target
Name:
Glucagon-like peptide 1 receptor
Synonyms:
GLP1R_RAT | Glp1r | Glpr
Type:
PROTEIN
Mol. Mass.:
52889.73
Organism:
Rattus norvegicus
Description:
ChEMBL_855307
Residue:
463
Sequence:
MAVTPSLLRLALLLLGAVGRAGPRPQGATVSLSETVQKWREYRHQCQRFLTEAPLLATGLFCNRTFDDYACWPDGPPGSFVNVSCPWYLPWASSVLQGHVYRFCTAEGIWLHKDNSSLPWRDLSECEESKQGERNSPEEQLLSLYIIYTVGYALSFSALVIASAILVSFRHLHCTRNYIHLNLFASFILRALSVFIKDAALKWMYSTAAQQHQWDGLLSYQDSLGCRLVFLLMQYCVAANYYWLLVEGVYLYTLLAFSVFSEQRIFKLYLSIGWGVPLLFVIPWGIVKYLYEDEGCWTRNSNMNYWLIIRLPILFAIGVNFLVFIRVICIVIAKLKANLMCKTDIKCRLAKSTLTLIPLLGTHEVIFAFVMDEHARGTLRFVKLFTELSFTSFQGFMVAVLYCFVNNEVQMEFRKSWERWRLERLNIQRDSSMKPLKCPTSSVSSGATVGSSVYAATCQNSCS
  
Inhibitor
Name:
BDBM50393587
Synonyms:
CHEMBL2158408
Type:
Small organic molecule
Emp. Form.:
C52H60N4O16
Mol. Mass.:
997.05
SMILES:
CCCC(=O)Oc1ccc(cc1OC)[C@H]1[C@@](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)([C@@H](c2ccc(OC(=O)CCC)c(OC)c2)[C@]1(NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)C(O)=O)C(O)=O |r,wU:14.14,48.52,33.35,15.16,wD:48.70,15.73,(11.3,-3.28,;11.27,-1.74,;9.92,-.99,;9.89,.55,;11.21,1.34,;8.55,1.29,;7.23,.5,;7.25,-1.04,;5.93,-1.83,;4.59,-1.08,;4.56,.45,;5.87,1.25,;5.84,2.79,;7.16,3.58,;3.27,-1.87,;3.27,-3.42,;4.34,-4.53,;4.33,-6.07,;2.99,-6.83,;5.66,-6.85,;5.64,-8.39,;6.96,-9.17,;8.31,-8.41,;9.63,-9.19,;9.62,-10.73,;10.95,-11.5,;8.29,-11.49,;8.28,-13.03,;6.94,-13.79,;9.6,-13.8,;8.28,-14.57,;8.31,-6.86,;6.99,-6.08,;1.73,-3.41,;.94,-4.71,;1.66,-6.06,;.88,-7.38,;-.67,-7.35,;-1.47,-8.66,;-3.01,-8.63,;-3.75,-7.28,;-3.81,-9.94,;-3.07,-11.3,;-3.88,-12.61,;-1.41,-5.99,;-2.95,-5.96,;-3.68,-4.6,;-.61,-4.68,;1.73,-1.88,;.96,-.54,;1.73,.79,;3.27,.79,;.96,2.12,;1.73,3.45,;.96,4.78,;-.58,4.78,;-1.35,6.12,;-.58,7.45,;-1.36,8.79,;.96,7.45,;1.72,8.8,;3.26,8.8,;.95,10.13,;2.48,10.13,;-1.35,3.44,;-.57,2.11,;.19,-1.88,;-.58,-.54,;-.58,-3.21,;4.81,-3.41,;5.58,-4.75,;5.33,-2.35,)|
Structure:
Search PDB for entries with ligand similarity: