Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 11/20 | 0.57 |
| ▸ | GRM5 | P41594 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | MAOA | P21397 | 9/20 | 0.56 |
| ▸ | TOP1 | P11387 | 1/20 | 0.49 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28644735 | 0.83 | MAPK1 (0.44) | MAOBNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28644751 | 0.82 | CYP19A1 (0.45) | MAOBGRM5NPC1ALDH1A1HPGD | |
| SCHEMBL6301799 | 0.79 | CYP19A1 (0.53) | MAOBMAOAKDM1A | |
| SCHEMBL31748950 | 0.76 | MAOB (0.61) | MAOBGRM5NPC1ALDH1A1HPGD | |
| SCHEMBL6301379 | 0.74 | ALDH1A1 (0.49) | MAOBALDH1A1HPGDMAOA | |
| SCHEMBL327001 | 0.74 | MAOB (0.84) | MAOBGRM5NPC1ALDH1A1HPGD | |
| SCHEMBL31683484 | 0.74 | MAOB (0.56) | MAOBGRM5NPC1ALDH1A1HPGD | |
| SCHEMBL10721464 | 0.73 | CYP19A1 (0.50) | GSTP1KDM1A | |
| SCHEMBL2326572 | 0.73 | MAOB (1.00) | MAOBGRM5NPC1ALDH1A1HPGD | |
| SCHEMBL8182443 | 0.73 | CRBN (0.67) | MAOBNPC1MAOAMAPT |
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-113603578-A | Lignan compound and synthesis method thereof | 山东大学 | 2021-11-05 | — | — | CN | disclosed |