Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 4/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.44 |
| ▸ | PDK3 | Q15120 | 4/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 4/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 7/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 5/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864440 | 1.00 | PDK1 (0.44) | PDK1PDK2PDK3PDK4NR1I2 | |
| SCHEMBL7861134 | 0.90 | PGR (0.44) | PGRNR3C1SLC6A4ADORA3SLC6A2 | |
| SCHEMBL7861149 | 0.85 | ESR1 (0.42) | NR1I2PGRNR3C1SLC6A4ADORA3 | |
| SCHEMBL7864495 | 0.80 | PGR (0.47) | PGRNR3C1SLC6A4ADORA3SLC6A2 | |
| SCHEMBL7854422 | 0.78 | PGR (0.48) | PDK1PDK2PDK3PDK4NR1I2 | |
| SCHEMBL7861152 | 0.78 | PGR (0.48) | PDK1PDK2PDK3PDK4NR1I2 | |
| SCHEMBL7854625 | 0.76 | PGR (0.58) | PGRNR3C1SLC6A4ADORA3SLC6A2 | |
| SCHEMBL7862390 | 0.76 | PGR (0.45) | PGRNR3C1SLC6A4ADORA3SLC6A2 | |
| SCHEMBL7854433 | 0.76 | PGR (0.49) | PGRNR3C1SLC6A4ADORA3SLC6A2 | |
| SCHEMBL7860091 | 0.75 | PGR (0.46) | PGRNR3C1SLC6A4ADORA3SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0709394-B1 | Steroids with a 17-spiromethylene lactone or lactol group | AKZO NOBEL NV (NL) | 2001-01-31 | — | — | EP | disclosed |
| US-5741786-A | PROGESTATIONAL ACTIVITY, USED AS CONTRACEPTIVES | AKZO NOBEL N.V. (NL) | 1998-04-21 | — | — | US | disclosed |
| EP-0709394-A2 | Steroids with a 17-spiromethylene lactone or lactol group | Akzo Nobel N.V. (NL) | 1996-05-01 | — | — | EP | disclosed |