Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.94 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.94 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.94 |
| ▸ | HPGD | P15428 | 5/20 | 0.94 |
| ▸ | THRB | P10828 | 1/20 | 0.94 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.62 |
| ▸ | FYN | P06241 | 1/20 | 0.62 |
| ▸ | MAOA | P21397 | 1/20 | 0.62 |
| ▸ | ACHE | P22303 | 1/20 | 0.62 |
| ▸ | AHR | P35869 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 7/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.56 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Benzo[E]Pyrene SCHEMBL29357057 | 0.97 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL29432647 | 0.97 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL24020 | 0.97 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL4983272 | 0.97 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL27891669 | 0.94 | ALDH1A1 (0.94) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL27818707 | 0.94 | ALDH1A1 (0.94) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL28053846 | 0.94 | ALDH1A1 (0.94) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL1179468 | 0.94 | ALDH1A1 (0.94) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| Benzo[E]Pyrene SCHEMBL28088020 | 0.94 | ALDH1A1 (0.94) | ALDH1A1HSD17B10CYP1A2HPGDTHRB | |
| SCHEMBL4850598 | 0.92 | ALDH1A1 (0.89) | ALDH1A1HSD17B10CYP1A2HPGDTHRB |
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-110526938-B | Deep blue photo-thermal activation delayed fluorescence material, preparation method thereof and electroluminescent device | 武汉华星光电半导体显示技术有限公司 | 2022-09-09 | — | — | CN | claimed |
| CN-110526938-B | Deep blue photo-thermal activation delayed fluorescence material, preparation method thereof and electroluminescent device | 武汉华星光电半导体显示技术有限公司 | 2022-09-09 | — | — | CN | disclosed |