Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.40 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL16483435 | 0.93 | PDGFRB (0.46) | CYP2A6PDGFRBPDGFRAHSP90AA1NPC1 | |
| SCHEMBL16483465 | 0.89 | ERN1 (0.48) | CYP2A6PDGFRBPDGFRAHSP90AA1NPC1 | |
| SCHEMBL16483436 | 0.89 | POLB (0.50) | HSP90AA1NPC1POLBRAB9AMMP9 | |
| SCHEMBL16483088 | 0.86 | NPC1 (0.54) | CYP2A6PDGFRBPDGFRANPC1POLB | |
| SCHEMBL29377530 | 0.86 | CYP2A6 (0.55) | CYP2A6PDGFRBPDGFRAHSP90AA1NPC1 | |
| SCHEMBL16483484 | 0.85 | POLB (0.49) | HSP90AA1NPC1POLBRAB9AMMP9 | |
| SCHEMBL16483650 | 0.85 | PDGFRB (0.47) | CYP2A6PDGFRBPDGFRANPC1POLB | |
| SCHEMBL16483100 | 0.85 | PDGFRB (0.54) | CYP2A6PDGFRBPDGFRABIRC5PIK3CD | |
| SCHEMBL15497834 | 0.85 | PDGFRB (0.51) | CYP2A6PDGFRBPDGFRABIRC5PIK3CD | |
| SCHEMBL15497847 | 0.84 | PDGFRB (0.54) | CYP2A6PDGFRBPDGFRABIRC5PIK3CD |
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-2014057873-A1 | PHOSPHINE OXIDE DERIVATIVE AND LIGHT-EMITTING ELEMENT PROVIDED WITH SAME | 東レ株式会社 (JP) | 2014-04-17 | — | — | WO | disclosed |