Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.58 |
| ▸ | ACHE | P22303 | 5/20 | 0.58 |
| ▸ | MAOB | P27338 | 5/20 | 0.58 |
| ▸ | BCHE | P06276 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR7 | P34969 | 2/20 | 0.49 |
| ▸ | HTR6 | P50406 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28031507 | 0.99 | SIGMAR1 (0.58) | SIGMAR1ACHEMAOBBCHETDP1 | |
| SCHEMBL28031540 | 0.91 | SIGMAR1 (0.59) | SIGMAR1ACHEMAOBTDP1ALDH1A1 | |
| SCHEMBL10518734 | 0.83 | DRD3 (0.57) | SIGMAR1MAOBHRH3HTR2A | |
| SCHEMBL10517239 | 0.79 | MAOB (0.63) | SIGMAR1MAOBTDP1L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9201224 | 0.77 | SIGMAR1 (0.46) | SIGMAR1ACHEMAOBBCHEMAOA | |
| SCHEMBL27746734 | 0.76 | MAOB (0.63) | SIGMAR1MAOBTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL12009588 | 0.74 | MAOB (0.54) | SIGMAR1MAOBTDP1ALDH1A1MAOA | |
| SCHEMBL11651182 | 0.74 | MAOB (0.68) | ACHEMAOBALDH1A1MAOA | |
| SCHEMBL28675845 | 0.73 | XDH (0.66) | ACHEMAOBBCHETDP1CYP2D6 | |
| SCHEMBL28030948 | 0.73 | SIGMAR1 (1.00) | SIGMAR1ACHEMAOBBCHE |
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-102993147-B | 4-chromone and 4-chromanone compound and purposes | SHENYANG PHARMACEUTICAL UNIVERSITY (CN) | 2015-09-09 | — | — | CN | disclosed |