Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MC5R | P33032 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29627289 | 0.99 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EL3MBTL1 | |
| SCHEMBL29627345 | 0.99 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EL3MBTL1 | |
| SCHEMBL29627335 | 0.99 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EL3MBTL1 | |
| SCHEMBL29627287 | 0.99 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EL3MBTL1 | |
| SCHEMBL29627301 | 0.96 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EL3MBTL1 | |
| SCHEMBL29627305 | 0.95 | SIGMAR1 (0.38) | SIGMAR1CYP2A6POLBKDM4EALDH1A1 | |
| SCHEMBL29627277 | 0.94 | SIGMAR1 (0.37) | SIGMAR1CYP2A6POLBKDM4EALDH1A1 | |
| SCHEMBL29627390 | 0.94 | SIGMAR1 (0.37) | SIGMAR1CYP2A6POLBKDM4EALDH1A1 | |
| SCHEMBL29627286 | 0.91 | SIGMAR1 (0.37) | SIGMAR1CYP2A6POLBKDM4EALDH1A1 | |
| SCHEMBL17468436 | 0.89 | SIGMAR1 (0.43) | SIGMAR1CYP2A6KDM4EL3MBTL1ALDH1A1 |
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-2022131768-A1 | ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME | 솔루스첨단소재 주식회사 | 2022-06-23 | — | — | WO | disclosed |