Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.51 |
| ▸ | TUBB | P07437 | 2/20 | 0.51 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.51 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.51 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.51 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.51 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.51 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.51 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.51 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.51 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.51 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.51 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.51 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.51 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28874860 | 1.00 | CYP2A6 (0.51) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1903000 | 0.84 | CYP2A6 (0.47) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6965217 | 0.84 | CYP2A6 (0.47) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1903001 | 0.84 | CYP2A6 (0.47) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6965215 | 0.84 | CYP2A6 (0.47) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL10761626 | 0.83 | TUBB4A (0.47) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL30963015 | 0.83 | CYP2A6 (0.56) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29247895 | 0.83 | CYP2A6 (0.56) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1226095 | 0.81 | CYP2A6 (0.58) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL1226099 | 0.81 | CYP2A6 (0.58) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1814848-B9 | 2,3,4-SUBSTITUTED-CYCLOPENTANONES AS THERAPEUTIC AGENTS | ALLERGAN INC (US) | 2011-12-21 | — | — | EP | disclosed |
| EP-1814848-B1 | 2,3,4-SUBSTITUTED-CYCLOPENTANONES AS THERAPEUTIC AGENTS | ALLERGAN INC (US) | 2010-07-28 | — | — | EP | disclosed |
| US-7183324-B2 | 2,3,4-substituted cyclopentanones as therapeutic agents | ALLERGAN, INC. (US) | 2007-02-27 | — | — | US | disclosed |
| US-7183324-B2 | 2,3,4-substituted cyclopentanones as therapeutic agents | ALLERGAN, INC. (US) | 2007-02-27 | — | — | US | disclosed |