Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 6/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 3/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | KLK1 | P06870 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31174123 | 0.88 | NOTUM (0.42) | F11AOC3HDAC6TNKSTNKS2 | |
| SCHEMBL31174073 | 0.87 | F11 (0.40) | F11AOC3HDAC6NOTUMKLK1 | |
| SCHEMBL31174040 | 0.83 | ALDH2 (0.33) | F11F2KLKB1ALDH2NOTUM | |
| SCHEMBL31174059 | 0.81 | TYMS (0.34) | F11F2KLKB1NOTUMKLK1 | |
| SCHEMBL31252430 | 0.81 | RXRA (0.34) | F11F2KLKB1NOTUMKLK1 | |
| SCHEMBL31174072 | 0.80 | F11 (0.33) | F11F2KLKB1NOTUMKLK1 | |
| SCHEMBL31252479 | 0.79 | F11 (0.33) | F11F2KLKB1NOTUM | |
| SCHEMBL31174108 | 0.78 | F11 (0.35) | F11F2KLKB1NOTUMCA12 | |
| SCHEMBL30995005 | 0.77 | MAP4K4 (0.41) | F11F2KLKB1AOC3NOTUM | |
| SCHEMBL29227912 | 0.77 | MAP4K4 (0.41) | F11F2KLKB1AOC3NOTUM |
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-118852163-A | Macrocyclic compound containing heteroatoms, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-10-29 | — | — | CN | disclosed |