Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(2R)-N-methyl-1-phenyl-N-prop-2-ynylpropan-2-amine
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 PubChem ID
CID: 26757
SID: 14797266
Canonical SMILES
C[C@H](Cc1ccccc1)N(C)CC#C
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Compound Formula C13H17N
Compound Structure
Protein Name
 Protein Info 
Amine oxidase [flavin-containing] B
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
P27338
Gene Name
MAOB
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4
 Cell Line Info 
Trichoplusia ni (Cabbage looper)  8
1
IC50 = 5.5 nM
   TI
   LI
   LO
   TS
2
IC50 = 7 nM
   TI
   LI
   LO
   TS
3
IC50 = 16.73 nM
   TI
   LI
   LO
   TS
4
IC50 = 17 nM
   TI
   LI
   LO
   TS
5
IC50 = 19 nM
   TI
   LI
   LO
   TS
6
IC50 = 19.6 nM
   TI
   LI
   LO
   TS
7
IC50 = 20 nM
   TI
   LI
   LO
   TS
8
IC50 = 38.6 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 221 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1.3 nM
2 IC50 = 6.13 nM
3 IC50 = 6.8 nM
4 IC50 = 7 nM
5 IC50 = 8 nM
6 IC50 = 9 nM
7 IC50 < 10 nM
8 IC50 = 11 nM
9 IC50 = 17 nM
10 IC50 = 18 nM
11 IC50 = 18.5 nM
12 IC50 = 19.6 nM
13 IC50 = 20 nM
14 IC50 = 35.6 nM
15 IC50 = 36 nM
16 IC50 = 42.84 nM
17 IC50 = 44 nM
18 IC50 = 45 nM
19 IC50 = 48 nM
20 IC50 = 56 nM
21 IC50 = 70 nM
22 IC50 = 71 nM
23 IC50 = 79 nM
24 IC50 = 94 nM
25 IC50 = 95 nM
26 IC50 = 270 nM
27 IC50 = 334 nM
28 IC50 = 2820 nM
29 IC50 = 2890 nM
30 IC50 = 10960 nM
31 IC50 = 14800 nM
32 Ki = 9 nM
33 Ki = 255 nM
34 Ki = 380 nM
35 Ki = 970 nM
36 Ki = 1960 nM