Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MPL | P40238 | 1/20 | 0.47 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL20390773 | 0.86 | CYP19A1 (0.65) | CYP19A1CYP2A6ALDH1A1NPC1RAB9A | |
| SCHEMBL1915039 | 0.83 | AR (0.48) | CYP19A1JAK2CYP2A6ALDH1A1NPC1 | |
| SCHEMBL1915656 | 0.78 | FFAR2 (0.48) | CYP19A1CYP2A6NPC1RAB9AMAPT | |
| SCHEMBL38521 | 0.77 | MAPT (0.53) | CYP19A1CYP2A6ALDH1A1NPC1RAB9A | |
| SCHEMBL27650045 | 0.74 | ALDH1A1 (0.71) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL234658 | 0.73 | ALDH1A1 (0.63) | CYP19A1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29796690 | 0.73 | ALDH1A1 (0.63) | CYP19A1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| Iodide SCHEMBL11486465 | 0.72 | ALDH1A1 (0.61) | CYP19A1ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3176320 | 0.72 | CYP2A6 (0.58) | JAK2CYP2A6MKNK1MKNK2 | |
| SCHEMBL10094614 | 0.71 | CYP2A6 (0.61) | JAK2CYP2A6MKNK1MKNK2 |
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-2011151436-A2 | NOVEL COMPOUNDS, METHOD FOR USE THEM AND PHARMACEUTICAL COMPOSITION CONTAINING THEM | EUROSCREEN S.A. (BE) | 2011-12-08 | — | — | WO | disclosed |