Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | MIF | P14174 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28575414 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP1A2F3HTTKMT2A | |
| SCHEMBL625785 | 0.83 | KMT2A (0.57) | ALDH1A1CYP1A2F3KMT2AMAOB | |
| SCHEMBL625784 | 0.83 | KMT2A (0.57) | ALDH1A1CYP1A2F3KMT2AMAOB | |
| SCHEMBL625589 | 0.83 | MAPK1 (0.45) | ALDH1A1HTTMAOBMIFMAOA | |
| SCHEMBL3056491 | 0.82 | ALDH1A1 (0.59) | ALDH1A1CYP1A2F3HTTKMT2A | |
| SCHEMBL624667 | 0.81 | MAPT (0.53) | ALDH1A1HTTKMT2AMAOBMIF | |
| Water SCHEMBL87641 | 0.81 | ALDH1A1 (0.57) | ALDH1A1CYP1A2F3HTTKMT2A | |
| SCHEMBL625103 | 0.79 | DYRK1A (0.60) | ALDH1A1CYP1A2HTTKMT2AMAOB | |
| SCHEMBL625104 | 0.79 | DYRK1A (0.60) | ALDH1A1CYP1A2HTTKMT2AMAOB | |
| SCHEMBL28587111 | 0.78 | EGFR (0.50) | ALDH1A1KMT2AMAOBMAOAMAPT |
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-112972441-B | Application of monocarbonyl curcumin compound in preparation of medicine for preventing and treating periodontitis | 温州医科大学附属口腔医院 | 2022-08-23 | — | — | CN | disclosed |
| CN-112972441-A | Application of monocarbonyl curcumin compound in preparation of medicine for preventing and treating periodontitis | 温州医科大学附属口腔医院 | 2021-06-18 | — | — | CN | disclosed |