Reaction Details Report a problem with these data
Target
Prepronociceptin
Ligand
BDBM464502
Substrate
n/a
Meas. Tech.
Receptor Binding Assay
Ki
15.0±n/a nM
Citation
 Kuehnert, S; Koenigs, RM; Jakob, F; Kless, A; Wegert, A; Ratcliffe, P; Jostock, R; Koch, T; Linz, K; Schroeder, W 3-((hetero-)aryl)-8-amino-2-oxo-1,3-diaza-spiro-[4.5]-decane derivatives US Patent  US10793528 Publication Date 10/6/2020 
Target
Name:
Prepronociceptin
Synonyms:
OFQ | PNOC | PNOC_HUMAN
Type:
Protein
Mol. Mass.:
20301.31
Organism:
Human
Description:
Q13519
Residue:
176
Sequence:
MKVLLCDLLLLSLFSSVFSSCQRDCLTCQEKLHPALDSFDLEVCILECEEKVFPSPLWTPCTKVMARSSWQLSPAAPEHVAAALYQPRASEMQHLRRMPRVRSLFQEQEEPEPGMEEAGEMEQKQLQKRFGGFTGARKSARKLANQKRFSEFMRQYLVLSMQSSQRRRTLHQNGNV
  
Inhibitor
Name:
BDBM464502
Synonyms:
US10793528, Example SC_5077
Type:
Small organic molecule
Emp. Form.:
C28H44N4O4
Mol. Mass.:
500.6734
SMILES:
CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)C(=O)NCCO)C(=O)N2CC2(O)CCC2)CC1)c1ccccc1 |r,wU:6.21,3.2,(5.85,3.82,;6.62,2.49,;8.16,2.49,;5.85,1.16,;5.08,-.18,;3.54,-.18,;2.77,1.16,;1.87,2.4,;.4,1.93,;-.93,2.7,;-2.26,1.93,;-3.03,.59,;-1.49,.59,;-3.6,2.7,;-3.6,4.24,;-4.93,1.93,;-6.27,2.7,;-7.6,1.93,;-8.93,2.7,;.4,.39,;-.84,-.52,;1.87,-.09,;2.34,-1.55,;1.31,-2.7,;2.75,-3.25,;-.23,-2.7,;-.23,-4.24,;1.31,-4.24,;3.54,2.49,;5.08,2.49,;6.62,-.18,;5.85,-1.51,;6.62,-2.84,;8.16,-2.84,;8.93,-1.51,;8.16,-.18,)|
Structure:
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