Reaction Details Report a problem with these data
Target
Neuropeptide Y receptor type 1
Ligand
BDBM50436472
Substrate
n/a
Meas. Tech.
ChEMBL_967923 (CHEMBL2400739)
IC50
>10000±n/a nM
Citation
 Luo, G; Chen, L; Hu, S; Huang, Y; Mattson, G; Iben, LG; Russell, JW; Clarke, WJ; Hogan, JB; Antal-Zimanyi, I; Poindexter, GS Heterocyclic modification of a novel bicyclo[3.1.0]hexane NPY1 receptor antagonist. Bioorg Med Chem Lett 23:3814-7 (2013) [PubMed]  Article 
Target
Name:
Neuropeptide Y receptor type 1
Synonyms:
NPY-Y1 | NPY1-R | NPY1R | NPY1R_HUMAN | NPYR | NPYY1 | neuropeptide Y receptor Y1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
44399.07
Organism:
Homo sapiens (Human)
Description:
NPY-Y1 NPY1R HUMAN::P25929
Residue:
384
Sequence:
MNSTLFSQVENHSVHSNFSEKNAQLLAFENDDCHLPLAMIFTLALAYGAVIILGVSGNLALIIIILKQKEMRNVTNILIVNLSFSDLLVAIMCLPFTFVYTLMDHWVFGEAMCKLNPFVQCVSITVSIFSLVLIAVERHQLIINPRGWRPNNRHAYVGIAVIWVLAVASSLPFLIYQVMTDEPFQNVTLDAYKDKYVCFDQFPSDSHRLSYTTLLLVLQYFGPLCFIFICYFKIYIRLKRRNNMMDKMRDNKYRSSETKRINIMLLSIVVAFAVCWLPLTIFNTVFDWNHQIIATCNHNLLFLLCHLTAMISTCVNPIFYGFLNKNFQRDLQFFFNFCDFRSRDDDYETIAMSTMHTDVSKTSLKQASPVAFKKINNNDDNEKI
  
Inhibitor
Name:
BDBM50436472
Synonyms:
CHEMBL2397298
Type:
Small organic molecule
Emp. Form.:
C25H33N3O2
Mol. Mass.:
407.5484
SMILES:
CCOc1cccc(c1)C1(C2CC(C)CC12)N1CCN(CC1)c1cccc(OC)n1 |(46.32,-30.8,;44.83,-30.41,;43.75,-31.5,;42.26,-31.11,;41.85,-29.62,;40.34,-29.23,;39.26,-30.33,;39.67,-31.81,;41.17,-32.21,;38.58,-32.91,;37.09,-33.23,;35.54,-33.24,;35.07,-31.77,;33.61,-31.3,;36.31,-30.86,;37.56,-31.77,;38.98,-34.39,;37.89,-35.48,;38.28,-36.95,;39.76,-37.36,;40.85,-36.28,;40.46,-34.79,;40.16,-38.84,;39.06,-39.93,;39.45,-41.42,;40.94,-41.82,;42.03,-40.73,;43.52,-41.13,;43.92,-42.62,;41.64,-39.24,)|
Structure:
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