Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.52 |
| ▸ | LMNA | P02545 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL5244694 | 0.88 | HPGD (0.48) | SMN1; SMN2LMNAALDH1A1KDM4EMAPT | |
| SCHEMBL3112834 | 0.86 | HPGD (0.43) | SMN1; SMN2LMNAALDH1A1MAPTNPC1 | |
| SCHEMBL5247650 | 0.85 | RAB9A (0.43) | SMN1; SMN2LMNAALDH1A1NPC1RAB9A | |
| SCHEMBL5246149 | 0.85 | RAB9A (0.43) | SMN1; SMN2ALDH1A1MAPTNPC1MEN1 | |
| Hydrochloric Acid SCHEMBL3117772 | 0.83 | RAB9A (0.41) | SMN1; SMN2LMNAALDH1A1KDM4EMAPT | |
| SCHEMBL3109364 | 0.82 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL3109368 | 0.82 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A | |
| SCHEMBL5248728 | 0.81 | ABCB1 (0.47) | SMN1; SMN2LMNAALDH1A1MAPTNPC1 | |
| SCHEMBL3112551 | 0.80 | XDH (0.45) | SMN1; SMN2ALDH1A1KDM4EHTTNPC1 | |
| SCHEMBL3113746 | 0.80 | RIPK1 (0.41) | SMN1; SMN2LMNAALDH1A1MAPTNPC1 |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |