Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29218629 | 0.86 | MAOB (0.37) | MAOBMAOAKDM1AGRIN2BTSHR | |
| SCHEMBL29218648 | 0.86 | MAOB (0.39) | MAOBMAOAKDM1AGRIN2BTSHR | |
| SCHEMBL29218632 | 0.77 | MAOA (0.35) | MAOBMAOAKDM1AGRIN2BHSD11B1 | |
| SCHEMBL31008881 | 0.77 | MAOB (0.35) | MAOBMAOAKDM1AGRIN2BTSHR | |
| SCHEMBL29218622 | 0.76 | OPRL1 (0.39) | GRIN2BTSHR | |
| SCHEMBL29218917 | 0.74 | MAOA (0.33) | MAOBMAOA | |
| SCHEMBL18884520 | 0.74 | TSHR (0.42) | TSHRLMNATYRNPC1ALDH1A1 | |
| SCHEMBL31008873 | 0.72 | KIF11 (0.38) | HSD11B1NPC1ALDH1A1RAB9AKMT2A | |
| SCHEMBL8532597 | 0.71 | — | — | |
| SCHEMBL29218784 | 0.70 | NPC1 (0.40) | MAOBMAOAKDM1ANPC1ALDH1A1 |
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-118076581-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-24 | — | — | CN | disclosed |