Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11354808 | 0.74 | AKR1C3 (0.44) | NPC1RAB9A | |
| SCHEMBL10294034 | 0.73 | ACHE (0.43) | EPHX1TP53MDM4MDM2CES2 | |
| SCHEMBL9856001 | 0.72 | KCNN4 (0.56) | KCNN4MAPTCYP1A2CYP2C19KIF11 | |
| SCHEMBL1492782 | 0.72 | KCNN4 (0.55) | KCNN4MAPTCYP1A2CYP2C19CES2 | |
| SCHEMBL4941607 | 0.70 | KCNN4 (0.53) | KCNN4TP53MDM4MDM2CYP1A2 | |
| SCHEMBL9044136 | 0.70 | KCNN4 (0.53) | KCNN4TP53MDM4MDM2CYP1A2 | |
| SCHEMBL31560818 | 0.70 | KCNN4 (0.53) | KCNN4CYP1A2CYP2C19CES2CES1 | |
| SCHEMBL1827704 | 0.70 | KCNN4 (0.53) | KCNN4TP53MDM4MDM2CYP1A2 | |
| SCHEMBL3934832 | 0.70 | KCNN4 (0.53) | KCNN4TP53MDM4MDM2CYP1A2 | |
| SCHEMBL9108451 | 0.69 | KMT2A (0.47) | KCNN4MAPTCYP1A2CYP2C19KIF11 |
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-118125950-A | Chiral alpha-amino acid derivative and preparation method and application thereof | 四川大学 | 2024-06-04 | — | — | CN | disclosed |