Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MARS1 | P56192 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 4/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.43 |
| ▸ | F11 | P03951 | 7/20 | 0.42 |
| ▸ | KLK1 | P06870 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.39 |
| ▸ | F9 | P00740 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30995033 | 1.00 | MARS1 (0.44) | MARS1F2NOTUMF11KLK1 | |
| SCHEMBL30499861 | 0.84 | F11 (0.48) | MARS1F11ALDH1A1KLKB1 | |
| SCHEMBL30995006 | 0.82 | ALDH1A1 (0.49) | MARS1F2NOTUMF11KLK1 | |
| SCHEMBL30995016 | 0.78 | NOTUM (0.41) | NOTUMF11KLKB1KCNH2AOC3 | |
| SCHEMBL11117017 | 0.76 | NOTUM (0.56) | MARS1F2NOTUMALDH1A1NPSR1 | |
| SCHEMBL30995067 | 0.74 | NOTUM (0.38) | MARS1F2NOTUMALDH1A1NPSR1 | |
| SCHEMBL30995055 | 0.74 | F11 (0.40) | F2NOTUMF11KLKB1 | |
| SCHEMBL30995013 | 0.74 | F11 (0.40) | F2NOTUMF11KLKB1 | |
| SCHEMBL17479508 | 0.73 | MARS1 (0.48) | MARS1F2NOTUMF11KLK1 | |
| SCHEMBL30995034 | 0.71 | F11 (0.48) | F11KLK1F9 |
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-118126046-A | Substituted macrocyclic compound, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-06-04 | — | — | CN | disclosed |