Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL28681841 | 0.85 | CYP1A2 (0.41) | PTGESRAB9AHPGDNPC1CYP3A4 | |
| SCHEMBL29937128 | 0.74 | CYP1A2 (0.41) | PTGESHPGDCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL5312118 | 0.74 | CYP1A2 (0.41) | PTGESHPGDCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL23043140 | 0.74 | CYP1A2 (0.39) | PDPK1PTGESRAB9AHPGDNPC1 | |
| SCHEMBL29937420 | 0.74 | CYP1A2 (0.39) | PDPK1PTGESRAB9AHPGDNPC1 | |
| SCHEMBL29344202 | 0.72 | CYP2A6 (0.37) | HPGDSMN1; SMN2CYP1A2CYP2A6MEN1 | |
| SCHEMBL28671216 | 0.72 | IDO1 (0.33) | IDO1 | |
| SCHEMBL25916103 | 0.72 | ALDH1A1 (0.33) | RAB9AHPGDNPC1SMN1; SMN2MEN1 | |
| SCHEMBL2362910 | 0.69 | ALDH1A1 (0.61) | HPGDCYP3A4CYP1A2CYP2A6MEN1 | |
| SCHEMBL24225403 | 0.68 | AHR (0.54) | PTGESCYP3A4CYP1A2CYP2D6CYP2C9 |
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 |