Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 2/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.58 |
| ▸ | PGR | P06401 | 5/20 | 0.58 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.58 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.58 |
| ▸ | DRD3 | P35462 | 1/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.58 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.57 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.57 |
| ▸ | PDK3 | Q15120 | 4/20 | 0.57 |
| ▸ | PDK4 | Q16654 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.44 |
| ▸ | SHBG | P04278 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5173779 | 1.00 | NR1I2 (0.62) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL6056205 | 0.85 | NR1I2 (0.47) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL3444251 | 0.85 | PDK1 (0.70) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL3173361 | 0.85 | PDK1 (0.70) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL8467502 | 0.84 | PGR (0.56) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL5200586 | 0.80 | PDK1 (0.56) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL354932 | 0.80 | PGR (0.49) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL13770133 | 0.80 | PDK1 (0.57) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL9663211 | 0.78 | PGR (0.45) | NR1I2SLC6A4PGRNR3C1ADORA3 | |
| SCHEMBL5074748 | 0.78 | PGR (0.45) | NR1I2SLC6A4PGRNR3C1ADORA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1778716-A1 | PROCESS FOR THE PREPARATION OF 3-OXIMINO STEROIDS | Sicor Inc. (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006020885-A1 | PROCESS FOR THE PREPARATION OF 3-OXIMINO STEROIDS | SICOR, INC. (US) | 2006-02-23 | — | — | WO | disclosed |