Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10015450 | 0.78 | AKR1C3 (0.41) | AKR1C3AKR1C2GPR84ALDH1A1NPC1 | |
| SCHEMBL31026102 | 0.78 | AKR1C3 (0.41) | AKR1C3AKR1C2GPR84ALDH1A1NPC1 | |
| SCHEMBL17613263 | 0.70 | — | — | |
| SCHEMBL29956444 | 0.65 | NPC1 (0.41) | GPR84ALDH1A1NPC1RAB9APLA2G1B | |
| SCHEMBL21102244 | 0.65 | NPC1 (0.41) | GPR84ALDH1A1NPC1RAB9APLA2G1B | |
| SCHEMBL5952628 | 0.64 | ORAI1 (0.34) | ALDH1A1NFKB1 | |
| SCHEMBL17358859 | 0.63 | EGFR (0.48) | AKR1C3AKR1C2GPR84ALDH1A1NPC1 | |
| SCHEMBL25677940 | 0.62 | LMNA (0.40) | ALDH1A1NPC1RAB9ALMNATP53 | |
| SCHEMBL5952636 | 0.62 | TRPV6 (0.38) | ALDH1A1ALOX15LMNA | |
| SCHEMBL19318456 | 0.62 | EGFR (0.50) | AKR1C3AKR1C2ALDH1A1NPC1RAB9A |
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-2014163211-A1 | ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE | CANON KABUSHIKI KAISHA (JP) | 2014-10-09 | — | — | WO | disclosed |