Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.45 |
| ▸ | HPRT1 | P00492 | 5/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | FYN | P06241 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29169707 | 0.85 | ALDH1A1 (0.48) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL9780249 | 0.83 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL9156598 | 0.76 | HSD17B10 (0.42) | ALDH1A1HSD17B10CYP1B1HIF1AHPRT1 | |
| SCHEMBL27171684 | 0.76 | PTPN22 (0.52) | ALDH1A1HSD17B10MAPTHPGDCYP2A6 | |
| SCHEMBL9914783 | 0.72 | HDAC4 (0.42) | CYP1B1HIF1ASOS1TSHRCYP1A2 | |
| SCHEMBL4849253 | 0.72 | ALDH1A1 (0.80) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL4852455 | 0.71 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL4854152 | 0.71 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL4853205 | 0.71 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT | |
| SCHEMBL4854598 | 0.71 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1B1HIF1AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022264826-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2022-12-22 | — | — | WO | disclosed |
| WO-2022264827-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2022-12-22 | — | — | WO | disclosed |