Reaction Details Report a problem with these data
Target
Neuroepithelial cell-transforming 1
Ligand
BDBM433681
Substrate
n/a
Meas. Tech.
Functional Uptake Assay (rNET)
IC50
130±n/a nM
Citation
 Shao, L; Wang, F; Malcolm, SC; Hewitt, MC; Bush, LR; Ma, J; Varney, MA; Campbell, U; Engel, SR; Hardy, LW; Koch, P; Campell, JE Cycloalkylamines as monoamine reuptake inhibitors US Patent  US10562878 Publication Date 2/18/2020 
Target
Name:
Neuroepithelial cell-transforming 1
Synonyms:
Net1 | Q498M6_RAT
Type:
Protein
Mol. Mass.:
61816.50
Organism:
Rat
Description:
Q498M6
Residue:
541
Sequence:
MVAHDEIGGLLPIKRTIRVLDVNNQPFREQEEPSNKRVRPLGRVTSLANLISPVRNGAVRRFGQTIQSFTLRGDHRSPASTQKSFSRATVPTPTKRRSSALWSEMLDISMKESLTTREIKRQEAIYELSRGEQDLIEDLKLARKAYHDPMLKLSIMSEEELTHIFGDLDAYIPLHEDLLARIGEATKPDGTVEQIGHILVNWLPGLNAYRGYCSNQLAAKALLDQKKQDPRVQDFLQRCLESPFSRKLDLWSFLDIPRSRLVKYPLLLKEILRHTPKDHLDVQLLEKAILIIQEVLSDINLKKGESECQYYIDKLEYLDEKQKDPRIEASKVLLCHGELKNKSGHKLYIFLFQDILVLTRPVTRNERHSYQVYRQPIPVQELVLEDLQDGDVRMGGSFRGAFGNSDKAKNIFRVRFQDPSPGQSHTLQANDVFHKQQWFNCIRSAIAPFQRAASPLELQGLPDLHEECEENNPSAGNLRAQRRSCVLPGVMQVDHESVLECGSSVQTSEDTRNAKAHRPQHGLRRARDKAQLGGKKKETLV
  
Inhibitor
Name:
BDBM433681
Synonyms:
US10562878, Compound 256
Type:
Small organic molecule
Emp. Form.:
C16H23Cl2NO
Mol. Mass.:
316.266
SMILES:
COC1CCC(CN(C)C)(CC1)c1ccc(Cl)c(Cl)c1 |(-4.89,-5.05,;-3.9,-3.87,;-2.39,-4.13,;-1.86,-5.58,;-.34,-5.85,;.65,-4.67,;1.64,-5.85,;1.11,-7.3,;2.1,-8.48,;-.41,-7.56,;.12,-3.22,;-1.4,-2.95,;1.98,-3.9,;3.31,-4.67,;4.65,-3.9,;4.65,-2.36,;5.98,-1.59,;3.31,-1.59,;3.31,-.05,;1.98,-2.36,)|
Structure:
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