Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 8/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | POLB | P06746 | 7/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.43 |
| ▸ | PTPRC | P08575 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28314083 | 0.91 | MAOA (0.67) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL28314104 | 0.91 | MAOA (0.67) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL28314829 | 0.85 | ALDH1A1 (0.63) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL28509366 | 0.83 | MAOA (0.80) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL28313235 | 0.81 | NPC1 (0.72) | MAOAMAOBALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL4444783 | 0.80 | ADORA2A (0.72) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL29361856 | 0.80 | ADORA2A (0.72) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL30377911 | 0.80 | ADORA2A (0.72) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL8773084 | 0.80 | ADORA2A (0.72) | MAOAMAOBADORA2AALDH1A1MAPK1 | |
| SCHEMBL487001 | 0.74 | MAOA (1.00) | MAOAMAOBADORA2AALDH1A1MAPK1 |
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-110066009-A | A kind of tourmaline containing anthraquinone compounds, preparation method and application | 厦门理工学院 | 2019-07-30 | — | — | CN | claimed |
| CN-110066009-A | A kind of tourmaline containing anthraquinone compounds, preparation method and application | 厦门理工学院 | 2019-07-30 | — | — | CN | disclosed |