Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL253443 | 0.85 | SLC6A2 (0.48) | EPHX1CYP3A4CYP2D6CYP2C19SLC6A3 | |
| SCHEMBL31146817 | 0.80 | HTR2A (0.47) | EPHX1SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL9771341 | 0.80 | LMNA (0.48) | MEN1KMT2A | |
| SCHEMBL8875932 | 0.79 | ALDH1A1 (0.45) | SLC6A3SLC6A4SLC6A2PPARGPPARA | |
| SCHEMBL3282141 | 0.76 | CYP2D6 (0.47) | MEN1KMT2AATMEPHX1TDP1 | |
| SCHEMBL9985184 | 0.76 | CYP19A1 (0.42) | MEN1KMT2AEPHX1TDP1CYP3A4 | |
| SCHEMBL27560189 | 0.76 | CYP19A1 (0.42) | MEN1KMT2AEPHX1TDP1CYP3A4 | |
| SCHEMBL9771325 | 0.76 | MEN1 (0.54) | MEN1KMT2ATDP1CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL9196881 | 0.74 | CYP2D6 (0.46) | MEN1KMT2AATMEPHX1TDP1 | |
| SCHEMBL21548166 | 0.73 | ESR1 (0.55) | MEN1KMT2AEPHX1TDP1CYP3A4 |
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-117695992-A | Full-continuous chemical synthesis device and method for atorvastatin calcium mother nucleus | 复旦大学 | 2024-03-15 | — | — | CN | disclosed |