Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | KCNA3 | P22001 | 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 | |
|---|---|---|---|---|
| SCHEMBL8433707 | 0.80 | MMP8 (0.43) | SIGMAR1SMN1; SMN2TDP1MMP8CASR | |
| SCHEMBL988882 | 0.79 | TSHR (0.48) | TSHRF2ALDH1A1F10CYP3A4 | |
| SCHEMBL8745342 | 0.78 | ZDHHC7 (0.41) | GAAMEN1KMT2AFAAH | |
| SCHEMBL28633131 | 0.78 | SMN1; SMN2 (0.51) | ALDH1A1CYP3A4CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL7178642 | 0.77 | ALDH1A1 (0.55) | TSHRF2ALDH1A1F10SMN1; SMN2 | |
| Benzene SCHEMBL19210846 | 0.76 | CYP3A4 (0.45) | F2ALDH1A1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL19233349 | 0.76 | CYP3A4 (0.45) | F2ALDH1A1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5961533 | 0.76 | GAA (0.40) | TSHRALDH1A1CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL15030939 | 0.75 | GAA (0.46) | TSHRALDH1A1CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL11157075 | 0.75 | TSHR (0.45) | TSHRF2ALDH1A1F10CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5891916-A | ANTINEUROGEGERATIVE AGENT | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-04-06 | — | — | US | disclosed |