Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29227143 | 1.00 | CYP1A1 (0.47) | CYP1A1CYP1B1MTNR1AMTNR1BLMNA | |
| SCHEMBL6498396 | 0.82 | MAPT (0.61) | CYP1A1CYP1B1MTNR1AMTNR1BLMNA | |
| SCHEMBL2604927 | 0.82 | MAPT (0.61) | CYP1A1CYP1B1MTNR1AMTNR1BLMNA | |
| SCHEMBL6491892 | 0.81 | ALDH1A1 (0.67) | CYP1A1CYP1B1LMNAMAPTBACE1 | |
| SCHEMBL6499271 | 0.79 | POLB (0.56) | CYP1A1CYP1B1LMNAMAPTBACE1 | |
| SCHEMBL2551628 | 0.79 | MTNR1A (0.51) | MTNR1AMTNR1BLMNAMAPTBACE1 | |
| SCHEMBL2551627 | 0.79 | MTNR1A (0.51) | MTNR1AMTNR1BLMNAMAPTBACE1 | |
| SCHEMBL9731206 | 0.78 | MTNR1A (0.57) | MTNR1AMTNR1BLMNAMAPTBACE1 | |
| SCHEMBL3268742 | 0.78 | MAPT (0.60) | MTNR1AMTNR1BLMNAMAPTCYP1A2 | |
| SCHEMBL6496200 | 0.77 | MEN1 (0.55) | CYP1A1CYP1B1LMNAMAPTBACE1 |
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 |