Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 9/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 9/20 | 1.00 |
| ▸ | CYP1B1 | Q16678 | 9/20 | 1.00 |
| ▸ | RAB9A | P51151 | 4/20 | 0.74 |
| ▸ | MAPT | P10636 | 2/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.74 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.68 |
| ▸ | NPC1 | O15118 | 3/20 | 0.67 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.63 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | JUN | P05412 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.59 |
| ▸ | P4HB | P07237 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL979409 | 0.91 | CYP1B1 (0.83) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL7368933 | 0.91 | CYP1B1 (0.83) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL13479662 | 0.91 | RAB9A (0.88) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL29600034 | 0.85 | RAB9A (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL5646960 | 0.85 | RAB9A (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL1604140 | 0.85 | RAB9A (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL29458617 | 0.84 | PFKFB3 (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL196640 | 0.84 | PFKFB3 (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL196639 | 0.84 | PFKFB3 (1.00) | CYP1A1CYP1A2CYP1B1RAB9AMAPT | |
| SCHEMBL979407 | 0.84 | CYP1B1 (0.78) | CYP1A1CYP1A2CYP1B1RAB9AMAPT |
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-2015166043-A1 | COMPOUNDS | DE MONTFORT UNIVERSITY (GB) | 2015-11-05 | — | — | WO | disclosed |