Found 2 hits Enz. Inhib. hit(s) with Target = 'Glucagon-like peptide 1 receptor' and Ligand = 'BDBM50393574' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Glucagon-like peptide 1 receptor
(Rattus norvegicus) | BDBM50393574
(CHEMBL2158422)Show SMILES COc1cc(ccc1OC(=O)c1cccs1)[C@H]1[C@@](NC(=O)c2ccc(NC(C)=O)cc2)([C@@H](c2ccc(OC(=O)c3cccs3)c(OC)c2)[C@]1(NC(=O)c1ccc(NC(C)=O)cc1)C(O)=O)C(O)=O |r,wU:16.17,48.54,31.34,17.19,wD:48.68,17.71,(32.36,-35.86,;31.04,-36.65,;29.69,-35.9,;28.37,-36.69,;27.03,-35.94,;27,-34.41,;28.31,-33.61,;29.67,-34.36,;30.98,-33.57,;30.96,-32.03,;29.61,-31.28,;32.2,-31.12,;33.67,-31.6,;34.58,-30.35,;33.67,-29.11,;32.21,-29.58,;25.71,-36.73,;25.71,-38.28,;26.78,-39.39,;26.77,-40.93,;25.43,-41.69,;28.1,-41.71,;28.08,-43.25,;29.4,-44.03,;30.75,-43.27,;32.07,-44.05,;32.06,-45.59,;30.72,-46.35,;33.39,-46.36,;30.75,-41.72,;29.43,-40.94,;24.17,-38.27,;23.38,-39.57,;24.1,-40.92,;23.31,-42.24,;21.77,-42.21,;20.97,-43.52,;21.71,-44.88,;23.24,-44.91,;20.76,-46.09,;19.21,-46.05,;18.69,-47.5,;19.91,-48.44,;21.18,-47.58,;21.03,-40.85,;19.49,-40.82,;18.75,-39.46,;21.83,-39.54,;24.17,-36.74,;23.4,-35.4,;24.17,-34.07,;25.71,-34.07,;23.4,-32.74,;24.17,-31.41,;23.4,-30.08,;21.86,-30.08,;21.09,-28.74,;21.86,-27.41,;23.4,-27.41,;21.08,-26.08,;21.09,-31.42,;21.87,-32.75,;22.63,-36.74,;21.86,-35.4,;21.86,-38.07,;27.25,-38.27,;28.02,-39.61,;27.77,-37.21,)| Show InChI InChI=1S/C48H40N4O14S2/c1-25(53)49-31-15-9-27(10-16-31)41(55)51-47(45(59)60)39(29-13-19-33(35(23-29)63-3)65-43(57)37-7-5-21-67-37)48(46(61)62,52-42(56)28-11-17-32(18-12-28)50-26(2)54)40(47)30-14-20-34(36(24-30)64-4)66-44(58)38-8-6-22-68-38/h5-24,39-40H,1-4H3,(H,49,53)(H,50,54)(H,51,55)(H,52,56)(H,59,60)(H,61,62)/t39-,40+,47+,48- | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The National Center for Drug Screening
Curated by ChEMBL
| Assay Description
Inhibition of [125I]GLP1 (7-36) amide binding to rat GLP1R expressed in HEK293 cells |
J Med Chem 55: 250-67 (2012)
Article DOI: 10.1021/jm201150j
BindingDB Entry DOI: 10.7270/Q2M046JC |
More data for this
Ligand-Target Pair | |
Glucagon-like peptide 1 receptor
(Rattus norvegicus) | BDBM50393574
(CHEMBL2158422)Show SMILES COc1cc(ccc1OC(=O)c1cccs1)[C@H]1[C@@](NC(=O)c2ccc(NC(C)=O)cc2)([C@@H](c2ccc(OC(=O)c3cccs3)c(OC)c2)[C@]1(NC(=O)c1ccc(NC(C)=O)cc1)C(O)=O)C(O)=O |r,wU:16.17,48.54,31.34,17.19,wD:48.68,17.71,(32.36,-35.86,;31.04,-36.65,;29.69,-35.9,;28.37,-36.69,;27.03,-35.94,;27,-34.41,;28.31,-33.61,;29.67,-34.36,;30.98,-33.57,;30.96,-32.03,;29.61,-31.28,;32.2,-31.12,;33.67,-31.6,;34.58,-30.35,;33.67,-29.11,;32.21,-29.58,;25.71,-36.73,;25.71,-38.28,;26.78,-39.39,;26.77,-40.93,;25.43,-41.69,;28.1,-41.71,;28.08,-43.25,;29.4,-44.03,;30.75,-43.27,;32.07,-44.05,;32.06,-45.59,;30.72,-46.35,;33.39,-46.36,;30.75,-41.72,;29.43,-40.94,;24.17,-38.27,;23.38,-39.57,;24.1,-40.92,;23.31,-42.24,;21.77,-42.21,;20.97,-43.52,;21.71,-44.88,;23.24,-44.91,;20.76,-46.09,;19.21,-46.05,;18.69,-47.5,;19.91,-48.44,;21.18,-47.58,;21.03,-40.85,;19.49,-40.82,;18.75,-39.46,;21.83,-39.54,;24.17,-36.74,;23.4,-35.4,;24.17,-34.07,;25.71,-34.07,;23.4,-32.74,;24.17,-31.41,;23.4,-30.08,;21.86,-30.08,;21.09,-28.74,;21.86,-27.41,;23.4,-27.41,;21.08,-26.08,;21.09,-31.42,;21.87,-32.75,;22.63,-36.74,;21.86,-35.4,;21.86,-38.07,;27.25,-38.27,;28.02,-39.61,;27.77,-37.21,)| Show InChI InChI=1S/C48H40N4O14S2/c1-25(53)49-31-15-9-27(10-16-31)41(55)51-47(45(59)60)39(29-13-19-33(35(23-29)63-3)65-43(57)37-7-5-21-67-37)48(46(61)62,52-42(56)28-11-17-32(18-12-28)50-26(2)54)40(47)30-14-20-34(36(24-30)64-4)66-44(58)38-8-6-22-68-38/h5-24,39-40H,1-4H3,(H,49,53)(H,50,54)(H,51,55)(H,52,56)(H,59,60)(H,61,62)/t39-,40+,47+,48- | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 118 | n/a | n/a | n/a | n/a |
The National Center for Drug Screening
Curated by ChEMBL
| Assay Description
Agonist activity at rat GLP1R expressed in HEK293 cells assessed as stimulation of cAMP levels incubated for 6 hrs by multiple response element/cAMP ... |
J Med Chem 55: 250-67 (2012)
Article DOI: 10.1021/jm201150j
BindingDB Entry DOI: 10.7270/Q2M046JC |
More data for this
Ligand-Target Pair | |
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