Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL23624495 | 0.98 | MAOA (0.50) | MAOAMAOBCYP1A2MMP3SQOR | |
| SCHEMBL18322222 | 0.88 | TSHR (0.52) | MAOAMAOBMMP3TSHRCYP11B2 | |
| SCHEMBL30451858 | 0.88 | TSHR (0.52) | MAOAMAOBMMP3TSHRCYP11B2 | |
| SCHEMBL23624359 | 0.85 | CYP1A2 (0.48) | MAOAMAOBCYP1A2MMP3TSHR | |
| SCHEMBL30709037 | 0.85 | MAOA (0.48) | MAOAMAOBCYP1A2MMP3TSHR | |
| SCHEMBL4446050 | 0.84 | MAOA (0.64) | MAOAMAOBCYP1A2MMP3TSHR | |
| SCHEMBL23635770 | 0.83 | MAOA (0.50) | MAOAMAOBCYP1A2MMP3TSHR | |
| SCHEMBL12295925 | 0.82 | CYP1A2 (0.57) | CYP1A2TSHRLMNATNKS | |
| SCHEMBL21416152 | 0.81 | MAOA (0.48) | MAOAMAOBCYP1A2MMP3TSHR | |
| SCHEMBL26492407 | 0.81 | GABRA1 (0.49) | MAOAMAOBMMP3TSHRCYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116903548-A | Compound, composition for organic electroluminescent device, and display device | SK株式会社 | 2023-10-20 | — | — | CN | disclosed |