Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MARS1 | P56192 | 7/20 | 0.62 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.46 |
| ▸ | RPA1 | P27694 | 2/20 | 0.45 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.45 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.43 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL25410772 | 0.82 | MARS1 (0.54) | MARS1MALT1MGLLMDM2P2RY14 | |
| SCHEMBL4692553 | 0.80 | MARS1 (0.62) | MARS1MALT1MGLLL3MBTL1MDM2 | |
| SCHEMBL29699906 | 0.78 | MARS1 (0.57) | MARS1MALT1RPA1P2RY14SLC16A3 | |
| SCHEMBL117498 | 0.77 | MARS1 (1.00) | MARS1MALT1RPA1 | |
| SCHEMBL25412969 | 0.76 | MARS1 (0.58) | MARS1MALT1MGLLMDM2P2RY14 | |
| SCHEMBL28554732 | 0.74 | MARS1 (0.61) | MARS1MALT1RPA1P2RY14SLC16A3 | |
| SCHEMBL23023643 | 0.74 | P2RY14 (0.51) | MARS1MALT1P2RY14SLC16A3HDAC6 | |
| SCHEMBL27992969 | 0.74 | SLC16A3 (0.53) | MALT1SLC16A3HDAC6SLC16A1MCTS1 | |
| SCHEMBL15056101 | 0.73 | P2RY14 (0.53) | MARS1MALT1MGLLP2RY14 | |
| SCHEMBL2455065 | 0.73 | GRN (0.64) | MARS1MALT1P2RY14SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023165168-A1 | APPLICATION OF PYRAZOLE DERIVATIVE AS β2 ADRENERGIC RECEPTOR ALLOSTERIC MODULATOR, ANTAGONIST AND AGONIST | 常州大学 | 2023-09-07 | — | — | WO | disclosed |