Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.57 |
| ▸ | MET | P08581 | 3/20 | 0.55 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MAP4K3 | Q8IVH8 | 3/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL488734 | 1.00 | NPC1 (0.61) | NPC1RAB9AMAPTMAP4K4MET | |
| SCHEMBL488178 | 0.84 | MAP4K4 (0.75) | MAP4K4METJAK2MAP4K3MGAM | |
| SCHEMBL487907 | 0.81 | MET (0.81) | MAP4K4METJAK2MAP4K3PTGER1 | |
| SCHEMBL488082 | 0.81 | MET (0.61) | NPC1RAB9AMAP4K4METJAK2 | |
| SCHEMBL487589 | 0.81 | MET (0.54) | MAP4K4METJAK2CYP3A4MAP4K3 | |
| Water SCHEMBL28121971 | 0.80 | MET (0.79) | MAP4K4METJAK2MAP4K3PTGER1 | |
| SCHEMBL15338674 | 0.79 | MAP4K4 (0.60) | MAP4K4METJAK2MAP4K3FYN | |
| SCHEMBL487837 | 0.78 | LMNA (0.53) | MAPTMAP4K4METJAK2ALDH1A1 | |
| SCHEMBL487861 | 0.78 | MET (0.57) | MAP4K4METJAK2MAP4K3FYN | |
| SCHEMBL30453222 | 0.78 | MET (0.57) | MAP4K4METJAK2MAP4K3FYN |
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-113181362-B | Medicament for preventing and/or treating amyotrophic lateral sclerosis | 国立大学法人京都大学 | 2023-06-13 | — | — | CN | disclosed |