Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| Water SCHEMBL28581624 | 0.98 | SMN1; SMN2 (0.60) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL28506467 | 0.89 | SMN1; SMN2 (0.51) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| SCHEMBL1870478 | 0.83 | HSD17B10 (0.48) | SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL12991730 | 0.82 | SMN1; SMN2 (0.66) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| SCHEMBL11971658 | 0.82 | SMN1; SMN2 (0.66) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| SCHEMBL16228133 | 0.80 | HSD17B10 (0.50) | SMN1; SMN2GAAALDH1A1KMT2AMEN1 | |
| SCHEMBL14621507 | 0.79 | HSD17B10 (0.45) | SMN1; SMN2GAAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6219127 | 0.79 | SMN1; SMN2 (0.67) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| SCHEMBL27362424 | 0.78 | SMN1; SMN2 (0.67) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 | |
| SCHEMBL14067410 | 0.78 | SMN1; SMN2 (0.67) | SMN1; SMN2GAAKDM4ESMYD3ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112279848-A | Pan-JAKs inhibitor and application thereof | 四川海思科制药有限公司 | 2021-01-29 | — | — | CN | disclosed |
| EP-1102789-A1 | MONOCYCLIC COMPOUNDS HAVING NK-2 ANTAGONIST ACTION AND COMPOSITIONS CONTAINING THEM | Menarini Ricerche S.p.A. (IT) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000008046-A1 | MONOCYCLIC COMPOUNDS HAVING NK-2 ANTAGONIST ACTION AND COMPOSITIONS CONTAINING THEM | MENARINI RICERCHE S.P.A. (IT) | 2000-02-17 | — | — | WO | disclosed |