Reaction Details Report a problem with these data
Target
Growth hormone secretagogue receptor type 1
Ligand
BDBM50379313
Substrate
n/a
Meas. Tech.
ChEMBL_811974 (CHEMBL2013344)
IC50
20±n/a nM
Citation
 Mihalic, JT; Kim, YJ; Lizarzaburu, M; Chen, X; Deignan, J; Wanska, M; Yu, M; Fu, J; Chen, X; Zhang, A; Connors, R; Liang, L; Lindstrom, M; Ma, J; Tang, L; Dai, K; Li, L Discovery of a new class of ghrelin receptor antagonists. Bioorg Med Chem Lett 22:2046-51 (2012) [PubMed]  Article 
Target
Name:
Growth hormone secretagogue receptor type 1
Synonyms:
GH-releasing peptide receptor | GHRP | GHS-R | GHSR | GHSR_HUMAN | Ghrelin Receptor (Growth Hormone Secretagogue Receptor Type 1) | Ghrelin receptor | Ghrelin receptor 1a (GHS-R1a)
Type:
Receptor
Mol. Mass.:
41334.57
Organism:
Homo sapiens (Human)
Description:
Receptor binding studies use plasma membranes from LLC PK-1 cells transiently transfected with hGHSR1a.
Residue:
366
Sequence:
MWNATPSEEPGFNLTLADLDWDASPGNDSLGDELLQLFPAPLLAGVTATCVALFVVGIAGNLLTMLVVSRFRELRTTTNLYLSSMAFSDLLIFLCMPLDLVRLWQYRPWNFGDLLCKLFQFVSESCTYATVLTITALSVERYFAICFPLRAKVVVTKGRVKLVIFVIWAVAFCSAGPIFVLVGVEHENGTDPWDTNECRPTEFAVRSGLLTVMVWVSSIFFFLPVFCLTVLYSLIGRKLWRRRRGDAVVGASLRDQNHKQTVKMLAVVVFAFILCWLPFHVGRYLFSKSFEPGSLEIAQISQYCNLVSFVLFYLSAAINPILYNIMSKKYRVAVFRLLGFEPFSQRKLSTLKDESSRAWTESSINT
  
Inhibitor
Name:
BDBM50379313
Synonyms:
CHEMBL2011891
Type:
Small organic molecule
Emp. Form.:
C30H37F2N3O3
Mol. Mass.:
525.6299
SMILES:
CC(C)[C@H](C[C@H]1CC[C@H](CC1)NCC1CC1)N1CC(=O)Nc2ccc(Oc3ccc(F)cc3F)cc2C1=O |r,wU:8.11,5.4,wD:3.17,(17.11,-33.7,;16.33,-35.03,;14.8,-35.02,;17.09,-36.36,;18.63,-36.37,;19.54,-35.12,;18.74,-33.82,;19.49,-32.47,;21.03,-32.45,;21.82,-33.77,;21.07,-35.1,;21.78,-31.11,;20.98,-29.78,;21.73,-28.43,;23.06,-27.63,;21.7,-26.87,;16.32,-37.69,;17.12,-39.15,;16.45,-40.64,;17.5,-41.89,;14.88,-41.02,;13.56,-40,;12.22,-40.77,;10.88,-40,;10.88,-38.47,;9.55,-37.7,;8.22,-38.47,;8.23,-40.02,;6.9,-40.8,;5.56,-40.02,;4.22,-40.79,;5.57,-38.49,;6.89,-37.72,;6.89,-36.17,;12.21,-37.69,;13.54,-38.45,;14.76,-37.43,;14.36,-35.95,)|
Structure:
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