Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Desogestrel. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR known ✓ | P06401 | 7/20 | 0.90 |
| ▸ | SHBG | P04278 | 8/20 | 0.90 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.90 |
| ▸ | ESR1 | P03372 | 6/20 | 0.90 |
| ▸ | AR | P10275 | 4/20 | 0.90 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.90 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.90 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.90 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.90 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.90 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.90 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.90 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.90 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.90 |
| ▸ | DRD3 | P35462 | 2/20 | 0.90 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.90 |
| ▸ | DRD1 | P21728 | 1/20 | 0.90 |
| ▸ | CCKBR | P32239 | 1/20 | 0.90 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.90 |
| ▸ | LMNA | P02545 | 6/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Desogestrel SCHEMBL41341 | 0.95 | SHBG (1.00) | SHBGPGRSLC6A4ESR1AR | |
| Desogestrel SCHEMBL13575760 | 0.95 | SHBG (1.00) | SHBGPGRSLC6A4ESR1AR | |
| Desogestrel SCHEMBL20353079 | 0.95 | SHBG (1.00) | SHBGPGRSLC6A4ESR1AR | |
| Desogestrel SCHEMBL14071563 | 0.95 | SHBG (1.00) | SHBGPGRSLC6A4ESR1AR | |
| Desogestrel SCHEMBL8853428 | 0.93 | SHBG (0.82) | SHBGPGRSLC6A4ESR1AR | |
| Etonogestrel SCHEMBL14941286 | 0.89 | SHBG (0.87) | SHBGPGRSLC6A4ESR1AR | |
| Desogestrel SCHEMBL8853260 | 0.85 | SHBG (0.73) | SHBGPGRSLC6A4ESR1AR | |
| Etonogestrel SCHEMBL8731710 | 0.85 | PGR (0.79) | SHBGPGRSLC6A4ESR1AR | |
| SCHEMBL10933534 | 0.84 | SHBG (0.79) | SHBGPGRSLC6A4ESR1AR | |
| SCHEMBL11335079 | 0.84 | SHBG (0.79) | SHBGPGRSLC6A4ESR1AR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115485561-A | Predicting response to PD-1 axis inhibitors | 豪夫迈·罗氏有限公司 | 2022-12-16 | — | — | CN | disclosed |
| CN-113056287-A | Conjugated chemical degradation inducers and methods of use | 豪夫迈·罗氏有限公司 | 2021-06-29 | — | — | CN | disclosed |
| CN-111601823-A | Targeting LILRB4 in cancer therapy with CAR-T or CAR-NK cells | 德克萨斯大学体系董事会 | 2020-08-28 | — | — | CN | disclosed |
| CN-111316101-A | Predicting responsiveness to cyclophosphamide therapy | 皇家墨尔本理工大学 | 2020-06-19 | — | — | CN | disclosed |