Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.59 |
| ▸ | HPGD | P15428 | 4/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | IDO1 | P14902 | 2/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13628768 | 0.81 | SGK1 (0.64) | MAPTALDH1A1KDM4EHPGDGAA | |
| SCHEMBL24175846 | 0.80 | MEN1 (0.78) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL14642552 | 0.76 | HPGD (0.55) | MAPTALDH1A1KDM4EHPGDGAA | |
| SCHEMBL16993698 | 0.76 | KDM4E (0.63) | MAPTALDH1A1KDM4EHPGDGAA | |
| SCHEMBL16993697 | 0.76 | KDM4E (0.63) | MAPTALDH1A1KDM4EHPGDGAA | |
| Hydrochloric Acid SCHEMBL6510818 | 0.75 | KDM4E (0.62) | MAPTALDH1A1KDM4EHPGDGAA | |
| Hydrochloric Acid SCHEMBL6510823 | 0.75 | KDM4E (0.62) | MAPTALDH1A1KDM4EHPGDGAA | |
| SCHEMBL13954727 | 0.75 | MAPT (0.67) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6494638 | 0.74 | POLB (0.78) | MAPTALDH1A1KDM4EGAAPOLB | |
| SCHEMBL14642553 | 0.74 | HPGD (0.51) | MAPTALDH1A1KDM4EHPGDGAA |
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-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | disclosed |