Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PTGIR | P43119 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21163706 | 0.87 | CYP3A4 (0.32) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL22780756 | 0.80 | HSD17B1 (0.36) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL21906420 | 0.79 | ALDH1A1 (0.36) | CYP3A4CYP2C9CYP2C19ALDH1A1NPC1 | |
| SCHEMBL21563899 | 0.79 | PTGIR (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL18884629 | 0.79 | PTGIR (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL22294807 | 0.79 | HSD17B1 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL7169458 | 0.78 | ALDH1A1 (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL13721286 | 0.78 | ALDH1A1 (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL22812841 | 0.78 | ALDH1A1 (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A | |
| SCHEMBL13721235 | 0.78 | ALDH1A1 (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3843167-A1 | ORGANIC ELECTROLUMINESCENCE ELEMENT | Kyushu University, National University Corporation (JP) | 2021-06-30 | — | — | EP | disclosed |