| Entry |
|
|---|
| Name |
Lonaprisan (USAN/INN) |
|---|
| Formula |
C28H29F5O3
|
|---|
| Exact mass |
508.2037
|
|---|
| Mol weight |
508.5201
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01667 Progesterone receptor antagonist
|
|---|
| Efficacy |
Antineoplastic, Progesterone receptor antagonist |
|---|
| Comment |
Treatment of progesterone receptor positive breast cancer
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Drug groups [BR:br08330]
Hormonal agent
DG01667 Progesterone receptor antagonist
D10016 Lonaprisan
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C3 (PGR)
D10016 Lonaprisan (USAN/INN)
|
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 36
1 C1x C 15.0435 -18.2672
2 C5x C 15.0435 -19.6456
3 C2x C 16.2151 -20.3348
4 C2y C 17.4557 -19.6456
5 C2y C 17.4557 -18.2672
6 C1x C 16.2151 -17.5780
7 C1x C 18.6273 -20.3348
8 C1x C 19.7989 -19.6456
9 C1y C 19.7989 -18.2672
10 C2y C 18.6273 -17.5780
11 C1y C 21.0394 -17.5780
12 C1z C 21.0394 -16.1997
13 C1x C 19.7989 -15.5105
14 C1y C 18.6273 -16.1997
15 C1x C 23.3826 -17.5780
16 C1x C 23.3826 -16.1997
17 C1z C 22.2110 -15.5105
18 O1a O 22.2110 -13.8521
19 C1d C 23.3826 -14.8213
20 X F 24.5542 -15.5105
21 C1d C 23.3826 -13.4430
22 X F 24.5763 -14.1321
23 X F 24.5763 -12.7538
24 X F 22.1890 -12.7538
25 X F 23.3826 -12.0647
26 C8y C 17.4308 -15.5153
27 C8x C 17.4251 -14.1324
28 C8x C 16.2285 -13.4482
29 C8y C 15.0377 -14.1423
30 C8x C 15.0434 -15.5252
31 C8x C 16.2400 -16.2094
32 C5a C 13.8412 -13.4581
33 C1a C 12.6799 -14.1350
34 O5a O 13.8340 -12.0652
35 O5x O 13.8470 -20.3300
36 C1a C 21.0394 -14.8213
BOND 40
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 2
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 17 18 1 #Up
22 19 20 1
23 17 19 1 #Down
24 19 21 1
25 19 22 1
26 21 23 1
27 21 24 1
28 21 25 1
29 14 26 1 #Up
30 26 27 2
31 27 28 1
32 28 29 2
33 29 30 1
34 30 31 2
35 26 31 1
36 29 32 1
37 32 33 1
38 32 34 2
39 2 35 2
40 12 36 1 #Up
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|---|
