Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 19/20 | 0.37 |
| ▸ | KLK1 | P06870 | 3/20 | 0.35 |
| ▸ | KLKB1 | P03952 | 8/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30752476 | 1.00 | F11 (0.37) | F11KLK1KLKB1CYP3A4NOTUM | |
| SCHEMBL30752475 | 0.78 | F11 (0.36) | F11KLKB1NOTUM | |
| SCHEMBL30752503 | 0.74 | F11 (0.36) | F11KLKB1CYP3A4 | |
| SCHEMBL24633366 | 0.73 | NOTUM (0.39) | F11KLKB1CYP3A4NOTUM | |
| SCHEMBL31174105 | 0.73 | NOTUM (0.39) | F11KLKB1CYP3A4NOTUM | |
| SCHEMBL30752470 | 0.72 | NOTUM (0.36) | F11KLKB1NOTUM | |
| SCHEMBL31174081 | 0.71 | F11 (0.41) | F11KLKB1CYP3A4 | |
| SCHEMBL24633461 | 0.71 | F11 (0.41) | F11KLKB1CYP3A4 | |
| SCHEMBL24633361 | 0.70 | F11 (0.41) | F11KLKB1CYP3A4 | |
| SCHEMBL21357358 | 0.69 | F11 (0.49) | F11KLKB1CYP3A4 |
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-117586284-A | Macrocyclic compound, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-02-23 | — | — | CN | disclosed |