Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ACP3 | P15309 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL28690443 | 0.86 | APP (0.56) | MAPK1TDP1MAPTALDH1A1NPC1 | |
| SCHEMBL7785663 | 0.81 | NFE2L2 (0.55) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| SCHEMBL7789425 | 0.81 | NFE2L2 (0.55) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| SCHEMBL7801278 | 0.81 | NFE2L2 (0.55) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| Hydrochloric Acid SCHEMBL7787525 | 0.80 | NFE2L2 (0.53) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| Trimethylammonium SCHEMBL28934709 | 0.76 | TSHR (0.51) | MAPK1TDP1MAPTALDH1A1NPC1 | |
| SCHEMBL7788967 | 0.75 | MAPK1 (0.51) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| SCHEMBL15325817 | 0.75 | ALDH1A1 (0.58) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| SCHEMBL11256672 | 0.74 | LMNA (0.56) | NFE2L2MAPK1NPSR1TDP1MAPT | |
| SCHEMBL7785642 | 0.74 | ACP3 (0.50) | NFE2L2MAPK1NPSR1TDP1MAPT |
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-114014879-A | Optically active biaryl borane adduct and preparation method and application thereof | 南开大学 | 2022-02-08 | — | — | CN | disclosed |