Reaction Details Report a problem with these data
Target
Glucagon-like peptide 1 receptor
Ligand
BDBM50393592
Substrate
n/a
Meas. Tech.
ChEMBL_855309 (CHEMBL2161793)
EC50
>20000±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:
Rat
Description:
ChEMBL_855307
Residue:
463
Sequence:
MAVTPSLLRLALLLLGAVGRAGPRPQGATVSLSETVQKWREYRHQCQRFLTEAPLLATGLFCNRTFDDYACWPDGPPGSFVNVSCPWYLPWASSVLQGHVYRFCTAEGIWLHKDNSSLPWRDLSECEESKQGERNSPEEQLLSLYIIYTVGYALSFSALVIASAILVSFRHLHCTRNYIHLNLFASFILRALSVFIKDAALKWMYSTAAQQHQWDGLLSYQDSLGCRLVFLLMQYCVAANYYWLLVEGVYLYTLLAFSVFSEQRIFKLYLSIGWGVPLLFVIPWGIVKYLYEDEGCWTRNSNMNYWLIIRLPILFAIGVNFLVFIRVICIVIAKLKANLMCKTDIKCRLAKSTLTLIPLLGTHEVIFAFVMDEHARGTLRFVKLFTELSFTSFQGFMVAVLYCFVNNEVQMEFRKSWERWRLERLNIQRDSSMKPLKCPTSSVSSGATVGSSVYAATCQNSCS
  
Inhibitor
Name:
BDBM50393592
Synonyms:
CHEMBL2158401
Type:
Small organic molecule
Emp. Form.:
C48H54N6O14
Mol. Mass.:
938.9742
SMILES:
COc1cc(ccc1NC(C)=O)[C@H]1[C@@](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)([C@@H](c2ccc(NC(C)=O)c(OC)c2)[C@]1(NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)C(O)=O)C(O)=O |r,wU:12.12,44.48,31.33,13.14,wD:44.66,13.69,(8.3,-7.3,;8.28,-5.76,;6.93,-5.02,;5.61,-5.81,;4.27,-5.06,;4.24,-3.52,;5.55,-2.73,;6.91,-3.47,;8.23,-2.68,;9.57,-3.43,;9.6,-4.97,;10.89,-2.63,;2.96,-5.85,;2.95,-7.39,;4.02,-8.5,;4.01,-10.04,;2.67,-10.8,;5.34,-10.82,;5.32,-12.36,;6.65,-13.14,;7.99,-12.38,;9.32,-13.16,;9.31,-14.7,;10.63,-15.48,;7.97,-15.46,;7.96,-17,;6.62,-17.76,;9.29,-17.78,;7.96,-18.54,;7.99,-10.83,;6.67,-10.06,;1.42,-7.39,;.62,-8.69,;1.35,-10.03,;.56,-11.36,;-.99,-11.32,;-1.79,-12.64,;-3.33,-12.6,;-4.07,-11.25,;-4.13,-13.92,;-1.73,-9.97,;-3.27,-9.93,;-4,-8.58,;-.93,-8.66,;1.41,-5.85,;.64,-4.52,;1.41,-3.18,;2.95,-3.18,;.64,-1.85,;1.41,-.52,;.65,.81,;-.9,.81,;-1.67,2.14,;-.9,3.48,;-1.67,4.81,;.64,3.48,;1.41,4.82,;2.95,4.82,;.63,6.15,;2.16,6.16,;-1.67,-.53,;-.89,-1.86,;-.13,-5.85,;-.9,-4.52,;-.9,-7.19,;4.49,-7.39,;5.26,-8.72,;5.01,-6.33,)|
Structure:
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