Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 10/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL12138030 | 0.83 | ALDH1A1 (1.00) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL16317016 | 0.83 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL2625555 | 0.78 | EPHX1 (0.67) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL3248424 | 0.77 | EPHX1 (0.61) | ALDH1A1SMN1; SMN2TSHREPHX1EPHX2 | |
| SCHEMBL3248423 | 0.77 | EPHX1 (0.61) | ALDH1A1SMN1; SMN2TSHREPHX1EPHX2 | |
| SCHEMBL8250809 | 0.76 | EPHX1 (0.70) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL2500706 | 0.74 | EPHX1 (0.54) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL2625559 | 0.74 | EPHX1 (0.61) | ALDH1A1SMN1; SMN2EPHX1EPHX2NPC1 | |
| SCHEMBL12824183 | 0.73 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2TSHREPHX1EPHX2 | |
| SCHEMBL4739321 | 0.73 | TSHR (0.55) | ALDH1A1SMN1; SMN2TSHREPHX1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008095058-A1 | HCV PROTEASE INHIBITORS | TAIGEN BIOTECHNOLOGY CO. LTD. (TW) | 2008-08-07 | — | — | WO | disclosed |