Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22454346 | 0.83 | NR5A1 (0.50) | RAB9ALMNAMAPTCYP3A4CYP2D6 | |
| SCHEMBL2676039 | 0.83 | NR5A1 (0.50) | RAB9ALMNAMAPTCYP3A4CYP2D6 | |
| SCHEMBL4754947 | 0.80 | NR5A1 (0.46) | RAB9AMAPTCYP3A4CYP2D6KDM4E | |
| SCHEMBL24270294 | 0.77 | L3MBTL1 (0.51) | ALDH2LMNACYP3A4 | |
| SCHEMBL14408963 | 0.76 | CYP2D6 (0.35) | RAB9AMAPTCYP3A4CYP2D6NPC1 | |
| SCHEMBL17186624 | 0.76 | HTR2A (0.44) | RAB9ALMNAMAPTCYP3A4CYP2D6 | |
| SCHEMBL14527008 | 0.76 | CYP2D6 (0.35) | RAB9AMAPTCYP3A4CYP2D6NPC1 | |
| SCHEMBL24270296 | 0.76 | KDM4E (0.42) | CYP3A4CYP2D6KDM4E | |
| SCHEMBL22454343 | 0.74 | RAB9A (0.57) | RAB9AMAPTKDM4ENPC1 | |
| SCHEMBL19229525 | 0.73 | MAPT (0.43) | ALDH2RAB9ALMNAMAPTCYP2D6 |
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-2020189519-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND COMPOUND | 国立大学法人九州大学 | 2020-09-24 | — | — | WO | disclosed |