| Entry |
|
|---|
| Name |
Aleniglipron L-alginine (USAN) |
|---|
| Formula |
C49H55FN9O6P. C6H14N4O2
|
|---|
| Exact mass |
1089.5114
|
|---|
| Mol weight |
1090.19
|
|---|
| Structure |
|
|---|
| Class |
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01493 GLP-1 receptor agonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Antidiabetic, Antiobesity, Glucagon-like peptide 1 (GLP-1) receptor agonist |
|---|
| Comment |
Treatment of type 2 diabetes mellitus (T2DM) and obesity
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01493 GLP-1 receptor agonist
DG03376 Aleniglipron
D13249 Aleniglipron L-alginine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Secretin receptor family
Glucagon
GLP1R
D13249 Aleniglipron L-alginine (USAN)
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01493 GLP-1 receptor agonist
DG03376 Aleniglipron
|
|---|
| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 78
1 C1x C 16.8807 -14.0089
2 N1y N 16.8807 -15.4098
3 C1y C 18.0714 -16.1102
4 C8y C 19.3322 -15.4098
5 C8y C 19.3322 -14.0089
6 C1x C 18.0714 -13.3084
7 C8y C 20.6631 -15.8300
8 N4y N 21.4336 -14.7093
9 N5x N 20.6631 -13.5886
10 C8y C 22.8345 -14.7093
11 C8x C 23.5349 -15.9001
12 C8y C 24.9358 -15.9001
13 C8y C 25.6362 -14.7093
14 C8y C 24.9358 -13.5186
15 C8x C 23.5349 -13.5186
16 C1a C 25.6362 -12.3278
17 X F 27.0371 -14.7093
18 C1a C 25.6362 -17.0908
19 N4y N 21.0834 -17.1609
20 C8x C 20.2428 -18.2816
21 C8x C 21.0834 -19.4023
22 N4y N 22.4142 -18.9820
23 C8y C 22.4142 -17.5811
24 O5x O 23.5349 -16.7406
25 C8y C 23.5349 -19.8226
26 C8x C 23.5349 -21.2234
27 C8x C 24.7257 -21.9239
28 C8y C 25.9865 -21.2234
29 C8y C 25.9865 -19.8226
30 C8x C 24.7257 -19.1221
31 C1a C 18.0714 -17.5111
32 C5a C 15.6899 -16.1102
33 C8y C 14.4992 -15.4098
34 O5a O 15.6899 -17.5111
35 C8x C 14.3591 -14.0089
36 C8y C 12.9582 -13.7287
37 C8y C 12.2578 -14.9195
38 N4y N 13.1683 -15.9701
39 C8x C 12.2578 -12.5379
40 C8y C 10.8569 -12.4679
41 C8x C 10.1564 -13.7287
42 C8x C 10.8569 -14.9195
43 C1y C 10.1564 -11.2771
44 C1x C 10.8569 -10.0864
45 C1x C 10.1564 -8.8256
46 O2x O 8.6855 -8.8256
47 C1x C 7.9851 -10.0163
48 C1x C 8.6855 -11.2771
49 C1z C 12.4679 -17.1609
50 C1x C 12.1177 -18.4917
51 C1y C 13.4485 -18.1415
52 C1a C 14.7794 -18.4917
53 C8y C 11.0670 -17.1609
54 N4x N 10.2265 -16.0402
55 C8y C 8.8956 -16.4604
56 O7x O 8.8956 -17.8613
57 N5x N 10.2265 -18.2816
58 O6a O 7.7049 -15.6199
59 N1b N 27.1772 -19.1221
60 C1a C 28.4380 -19.7525
61 P1a P 27.1772 -21.9239
62 C1b C 26.4768 -23.1146
63 O3b O 27.8777 -20.7331
64 C1b C 28.4380 -22.6243
65 C1a C 29.6288 -21.9239
66 C1a C 25.0759 -23.1146
67 C1b C 35.2842 -16.5238
68 C1b C 36.5445 -17.2239
69 C1c C 34.0939 -17.1539
70 C1b C 37.7348 -16.5238
71 C6a C 32.9036 -16.4538
72 N1a N 34.0939 -18.5543
73 N1b N 38.9250 -17.2239
74 O6a O 31.7133 -17.0839
75 O6a O 32.9036 -15.0534
76 C2c C 40.1853 -16.5938
77 N1a N 41.4457 -17.2940
78 N2a N 40.1853 -15.1234
BOND 86
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 2
8 7 8 1
9 8 9 1
10 5 9 2
11 8 10 1
12 10 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 10 15 1
18 14 16 1
19 13 17 1
20 12 18 1
21 7 19 1
22 19 20 1
23 20 21 2
24 21 22 1
25 22 23 1
26 19 23 1
27 23 24 2
28 22 25 1
29 25 26 2
30 26 27 1
31 27 28 2
32 28 29 1
33 29 30 2
34 25 30 1
35 3 31 1 #Down
36 2 32 1
37 32 33 1
38 32 34 2
39 33 35 2
40 35 36 1
41 36 37 1
42 37 38 1
43 33 38 1
44 36 39 2
45 39 40 1
46 40 41 2
47 41 42 1
48 37 42 2
49 43 40 1
50 43 44 1
51 44 45 1
52 45 46 1
53 46 47 1
54 47 48 1
55 43 48 1
56 49 38 1 #Down
57 50 51 1
58 51 49 1
59 49 50 1
60 51 52 1 #Up
61 49 53 1 #Up
62 53 54 1
63 54 55 1
64 55 56 1
65 56 57 1
66 53 57 2
67 55 58 2
68 29 59 1
69 59 60 1
70 28 61 1
71 61 62 1
72 61 63 2
73 61 64 1
74 64 65 1
75 62 66 1
76 67 68 1
77 67 69 1
78 68 70 1
79 69 71 1
80 69 72 1 #Down
81 70 73 1
82 71 74 1
83 71 75 2
84 73 76 1
85 76 77 1
86 76 78 2
|
|---|
