Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 5/20 | 0.72 |
| ▸ | LMNA | P02545 | 5/20 | 0.72 |
| ▸ | AR | P10275 | 4/20 | 0.72 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.72 |
| ▸ | ESR1 | P03372 | 3/20 | 0.72 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.72 |
| ▸ | SHBG | P04278 | 3/20 | 0.72 |
| ▸ | MEN1 | O00255 | 2/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.72 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.72 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.64 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Norbolethone SCHEMBL16755266 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL25867708 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL25868093 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| Norbolethone SCHEMBL548124 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| Norbolethone SCHEMBL7793965 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL11861988 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| Norbolethone SCHEMBL6716010 | 0.87 | PGR (0.73) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL13949610 | 0.85 | PGR (0.69) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL11860944 | 0.84 | PGR (0.69) | PGRLMNAARSLC6A4CYP3A4 | |
| SCHEMBL9619042 | 0.84 | PGR (0.66) | PGRLMNAARSLC6A4CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2354150-A1 | Process for the preparation of gestodene | LABORATOIRE THERAMEX (MC) | 2011-08-10 | — | — | EP | disclosed |