Reaction Details Report a problem with these data
Target
Prepronociceptin
Ligand
BDBM464508
Substrate
n/a
Meas. Tech.
Receptor Binding Assay
Ki
12.0±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:
BDBM464508
Synonyms:
US10793528, Example SC_5084
Type:
Small organic molecule
Emp. Form.:
C25H37FN4O2
Mol. Mass.:
444.5853
SMILES:
CN(C)[C@]1(CC[C@]2(CN(CC(C)(C)C(N)=O)C(=O)N2CC2CC2)CC1)c1cccc(F)c1 |r,wU:6.18,3.2,(3.42,3.76,;3.81,2.28,;5.3,1.88,;2.72,1.19,;1.95,-.15,;.41,-.15,;-.36,1.19,;-1.26,2.43,;-2.72,1.96,;-4.06,2.73,;-5.39,1.96,;-6.16,.62,;-4.62,.62,;-6.73,2.73,;-8.06,1.96,;-6.73,4.27,;-2.72,.42,;-3.97,-.49,;-1.26,-.06,;-.49,-1.39,;-1.26,-2.73,;-2.59,-3.5,;-1.26,-4.27,;.41,2.52,;1.95,2.52,;4.06,.42,;4.06,-1.12,;5.39,-1.89,;6.73,-1.12,;6.73,.42,;8.06,1.19,;5.39,1.19,)|
Structure:
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