Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2428467 | 0.82 | RAB9A (0.45) | POLBMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12444310 | 0.82 | BRD4 (0.48) | POLBMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2107054 | 0.82 | NOTUM (0.62) | POLBMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2109752 | 0.82 | RAB9A (0.45) | POLBMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28784608 | 0.80 | CYP1A2 (0.43) | POLBMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3723768 | 0.79 | NOTUM (0.43) | MAPTCYP3A4RAB9AMAPK1KDM4E | |
| SCHEMBL2489301 | 0.79 | RAB9A (0.50) | POLBMAPTRAB9AMAPK1ALDH1A1 | |
| SCHEMBL15107433 | 0.76 | KDM4E (0.53) | CYP1A2CYP2C19RAB9AGAAMAPK1 | |
| SCHEMBL2303625 | 0.75 | CTSS (0.52) | KDM4EALDH1A1LMNAMAOB | |
| SCHEMBL23603957 | 0.74 | BRD4 (0.49) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 |
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-1778683-A1 | THIOPHENE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-05-02 | — | — | EP | disclosed |
| WO-2005121134-A1 | THIOPHENE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | disclosed |