Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | PKLR | P30613 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | PDE6D | O43924 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | PDE6A | P16499 | 1/20 | 0.38 |
| ▸ | PDE6G | P18545 | 1/20 | 0.38 |
| ▸ | PDE6B | P35913 | 1/20 | 0.38 |
| ▸ | PDE6C | P51160 | 1/20 | 0.38 |
| ▸ | PDE6H | Q13956 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7010649 | 0.91 | PKM (0.46) | ALDH1A1SMN1; SMN2NPC1TSHRRAB9A | |
| SCHEMBL7008568 | 0.86 | PKM (0.41) | ALDH1A1SMN1; SMN2PKMPKLRTDP1 | |
| SCHEMBL7012894 | 0.82 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL7010543 | 0.74 | RAB9A (0.40) | ALDH1A1SMN1; SMN2NPC1TSHRRAB9A | |
| SCHEMBL7016038 | 0.74 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL7018272 | 0.74 | SMN1; SMN2 (0.44) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL7009974 | 0.72 | PKM (0.45) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL7012827 | 0.72 | TSHR (0.46) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL9240139 | 0.71 | KMT2A (0.70) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR | |
| SCHEMBL9239262 | 0.71 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2KMT2ANPC1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |