Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 2/20 | 0.42 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13062177 | 1.00 | CYP19A1 (0.47) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL13062171 | 0.88 | MEN1 (0.37) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL12949821 | 0.87 | PGR (0.49) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL13062197 | 0.85 | AR (0.45) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL13770130 | 0.85 | AR (0.45) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL13062188 | 0.81 | PGR (0.64) | CYP19A1PGRARNR3C2MEN1 | |
| SCHEMBL13013553 | 0.80 | AR (0.68) | CYP19A1PGRARNR3C2 | |
| SCHEMBL12942811 | 0.79 | PGR (0.50) | CYP19A1PGRARNR3C2NR3C1 | |
| SCHEMBL13062432 | 0.78 | PGR (0.62) | PGRARNR3C2NR3C1LMNA | |
| SCHEMBL12923951 | 0.77 | PGR (0.65) | CYP19A1PGRARNR3C2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009083268-A2 | 17-(1'-PROPENYL)-17-3'-OXIDOESTRA-4-EN-3-ONE DERIVATIVE, USE THEREOF, AND MEDICAMENT CONTAINING SAID DERIVATIVE | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-07-09 | — | — | WO | disclosed |