Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.35 |
| ▸ | PLA2G4A | P47712 | 3/20 | 0.35 |
| ▸ | TNKS | O95271 | 2/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23328499 | 0.94 | KDM4E (0.39) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL25544532 | 0.89 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL23328471 | 0.89 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL23328692 | 0.88 | KDM4E (0.38) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL25543480 | 0.88 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL12694853 | 0.86 | PLA2G2A (0.47) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL12694846 | 0.86 | PLA2G2A (0.47) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL26754223 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL23328492 | 0.85 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDMEN1NPC1 | |
| SCHEMBL25544702 | 0.85 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDMEN1NPC1 |
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-2021085817-A2 | TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 랩토 | 2021-05-06 | — | — | WO | disclosed |