Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.70 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.46 |
| ▸ | HSD11B2 | P80365 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.44 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 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 | |
|---|---|---|---|---|
| SCHEMBL31108372 | 1.00 | MEN1 (0.70) | MEN1CYP2C9KMT2AHSD11B1HSD11B2 | |
| SCHEMBL54982 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL30078304 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL28378542 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL30877914 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL24157288 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL30877902 | 0.85 | ESR1 (0.58) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| SCHEMBL743693 | 0.83 | MEN1 (1.00) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| Hydrogen Peroxide SCHEMBL2349581 | 0.83 | ESR1 (0.62) | MEN1CYP2C9KMT2AALDH1A1ESR1 | |
| Ammonia Solution, Strong SCHEMBL7989528 | 0.83 | ESR1 (0.56) | MEN1CYP2C9KMT2AALDH1A1ESR1 |
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-115515588-A | Macrocyclic ULK1/2 inhibitors | 萨克生物研究学院 | 2022-12-23 | — | — | CN | disclosed |