Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24371681 | 0.93 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL30455829 | 0.91 | ALDH1A1 (0.53) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL15677716 | 0.91 | ALDH1A1 (0.53) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL24371626 | 0.84 | PDK2 (0.43) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL18201428 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL24166421 | 0.82 | PDK2 (0.41) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL16017141 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL24371739 | 0.82 | ALDH1A1 (0.49) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL25609231 | 0.82 | ALDH1A1 (0.51) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 | |
| SCHEMBL14520997 | 0.81 | ALDH1A1 (0.55) | ALDH1A1CYP3A4HSD17B10HPGDPDK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220131092-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2022-04-28 | — | — | US | disclosed |