Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | TGM2 | P21980 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HRAS | P01112 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | MMP1 | P03956 | 2/20 | 0.31 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL172489 | 0.81 | MAPT (0.48) | ALDH1A1HSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6454577 | 0.80 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL69853 | 0.77 | CA2 (0.40) | ALDH1A1IDO1NPC1RAB9AMAPT | |
| SCHEMBL12881975 | 0.77 | APP (0.40) | ALDH1A1HSD17B10MAPTGAATP53 | |
| SCHEMBL7295754 | 0.77 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9AMAPTL3MBTL1 | |
| SCHEMBL1487475 | 0.75 | MEN1 (0.63) | ALDH1A1HSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL11840944 | 0.75 | RXFP1 (0.40) | ALDH1A1IDO1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL10465750 | 0.74 | ALDH1A1 (0.32) | ALDH1A1NPC1RAB9AGAA | |
| SCHEMBL10466115 | 0.74 | — | — | |
| SCHEMBL28652357 | 0.74 | — | — |
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-3147367-A1 | SMALL MOLECULE CONJUGATES FOR INTRACELLULAR DELIVERY OF NUCLEIC ACIDS | F. Hoffmann-La Roche AG (CH) | 2017-03-29 | — | — | EP | disclosed |