Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | GPR3 | P46089 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4822999 | 1.00 | MAOA (0.41) | MAOAALDH1A1SMN1; SMN2KDM1ANOX1 | |
| Iodide SCHEMBL7694591 | 0.98 | MAOA (0.39) | MAOAALDH1A1SMN1; SMN2KDM1ANOX1 | |
| SCHEMBL11773661 | 0.85 | BCHE (0.34) | MAOAALDH1A1SMN1; SMN2KDM1AMEN1 | |
| SCHEMBL7490673 | 0.81 | CYP2D6 (0.39) | ALDH1A1SMN1; SMN2MEN1KMT2AL3MBTL1 | |
| SCHEMBL11810556 | 0.80 | MAOA (0.37) | MAOAALDH1A1SMN1; SMN2KDM1AADRA2A | |
| SCHEMBL514686 | 0.80 | ALDH1A1 (0.35) | MAOAALDH1A1SMN1; SMN2KDM1ABCHE | |
| SCHEMBL303391 | 0.77 | MAOA (0.33) | MAOAALDH1A1SMN1; SMN2RAB9APOLB | |
| SCHEMBL12264201 | 0.75 | MAOA (0.46) | MAOAALDH1A1SMN1; SMN2KDM1ANOX1 | |
| SCHEMBL15493920 | 0.75 | KDM1A (0.40) | MAOAALDH1A1SMN1; SMN2KDM1ABCHE | |
| SCHEMBL18239231 | 0.75 | MEN1 (0.34) | MAOAKDM1AMEN1KMT2A |
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-118063452-A | Benzothiazole or benzoxazole derivative and preparation method and application thereof | 山东大学 | 2024-05-24 | — | — | CN | claimed |
| CN-118063452-A | Benzothiazole or benzoxazole derivative and preparation method and application thereof | 山东大学 | 2024-05-24 | — | — | CN | disclosed |