Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Etonogestrel. 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 | 8/20 | 1.00 |
| ▸ | SHBG | P04278 | 9/20 | 1.00 |
| ▸ | ESR1 | P03372 | 6/20 | 1.00 |
| ▸ | AR | P10275 | 6/20 | 1.00 |
| ▸ | OPRM1 | P35372 | 3/20 | 1.00 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.72 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.72 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.72 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.72 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.72 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.72 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.72 |
| ▸ | DRD1 | P21728 | 1/20 | 0.72 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.72 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.72 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.72 |
| ▸ | CCKBR | P32239 | 1/20 | 0.72 |
| ▸ | DRD3 | P35462 | 1/20 | 0.72 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.72 |
| ▸ | LMNA | P02545 | 5/20 | 0.71 |
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 | |
|---|---|---|---|---|
| Etonogestrel SCHEMBL484265 | 1.00 | SHBG (1.00) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL14946854 | 1.00 | SHBG (1.00) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL19510085 | 1.00 | SHBG (1.00) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL117703 | 1.00 | SHBG (1.00) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL6462179 | 1.00 | SHBG (1.00) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL28648883 | 0.99 | SHBG (0.98) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL14941286 | 0.93 | SHBG (0.87) | SHBGPGRESR1AROPRM1 | |
| SCHEMBL20851741 | 0.93 | SHBG (0.86) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL5729815 | 0.90 | SHBG (0.81) | SHBGPGRESR1AROPRM1 | |
| Etonogestrel SCHEMBL6150744 | 0.90 | SHBG (0.81) | SHBGPGRESR1AROPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20240082228-A1 | SARS-COV-2 THERAPEUTICS | MODEL MEDICINES INC (US) | 2024-03-14 | — | — | US | disclosed |
| US-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |
| CN-1198091-A | Intravaginal rings with insertable drug-containing core | POPULATION COUNCIL INC (US) | 1998-11-04 | — | — | CN | disclosed |