Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| Pyrene SCHEMBL16568699 | 0.98 | ALDH1A1 (0.56) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Pyrene SCHEMBL22499603 | 0.98 | ALDH1A1 (0.56) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Imidazole SCHEMBL2339222 | 0.86 | ALDH1A1 (0.52) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Imidazole SCHEMBL2121993 | 0.86 | ALDH1A1 (0.52) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Benzo[E]Pyrene SCHEMBL29274113 | 0.85 | ALDH1A1 (0.57) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Imidazole SCHEMBL29274111 | 0.83 | TNF (0.42) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Naphthalene SCHEMBL10693189 | 0.82 | ALDH1A1 (0.48) | ALDH1A1FKBP5HPGDHSD17B10TSHR | |
| Naphthalene SCHEMBL338629 | 0.82 | ALDH1A1 (0.65) | ALDH1A1FKBP5AHR | |
| Naphthalene SCHEMBL2123892 | 0.82 | ALDH1A1 (0.65) | ALDH1A1FKBP5AHR | |
| Imidazole SCHEMBL28923023 | 0.81 | ALDH1A1 (0.46) | ALDH1A1FKBP5HPGDHSD17B10TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113659086-A | White light organic electroluminescent device with low efficiency roll-off and high spectral stability and preparation method thereof | 盐城吉研智能科技有限公司 | 2021-11-16 | — | — | CN | claimed |
| CN-113659086-A | White light organic electroluminescent device with low efficiency roll-off and high spectral stability and preparation method thereof | 盐城吉研智能科技有限公司 | 2021-11-16 | — | — | CN | disclosed |