Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | PTGES | O14684 | 2/20 | 0.40 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29937154 | 0.76 | CYP1A2 (0.41) | CYP1A2CYP2A6PTGESCYP3A4CYP2C9 | |
| SCHEMBL24225407 | 0.75 | AHR (0.41) | CYP1A2PTGESTYMSCYP3A4CYP2C9 | |
| SCHEMBL23191346 | 0.74 | CCNE2 (0.37) | CYP1A2PTGESCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29650355 | 0.73 | CYP1A2 (0.54) | CYP1A2CYP2A6PTGESTYMSKDM4E | |
| SCHEMBL28658521 | 0.73 | CYP1A2 (0.54) | CYP1A2CYP2A6PTGESTYMSKDM4E | |
| SCHEMBL24493213 | 0.72 | PTGES (0.37) | CYP1A2PTGESCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6690250 | 0.70 | CYP1A2 (0.40) | CYP1A2PTGESCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4109731 | 0.69 | CYP1A2 (0.68) | CYP1A2CYP2A6TSHRLMNANR4A2 | |
| SCHEMBL7553197 | 0.69 | CYP2A6 (0.68) | CYP1A2CYP2A6KDM4EALDH1A1POLB | |
| SCHEMBL29915195 | 0.69 | CYP2A6 (0.68) | CYP1A2CYP2A6KDM4EALDH1A1POLB |
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-113880848-B | Compound and application thereof, and organic electroluminescent device comprising compound | 北京鼎材科技有限公司 | 2025-02-21 | — | — | CN | disclosed |
| CN-113880848-A | Compound, application thereof and organic electroluminescent device comprising compound | 北京鼎材科技有限公司 | 2022-01-04 | — | — | CN | disclosed |