Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 20/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 16/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24633487 | 1.00 | F11 (0.41) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL21357414 | 0.86 | F11 (0.51) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL31174105 | 0.85 | NOTUM (0.39) | F11KLKB1CYP3A4 | |
| SCHEMBL24633366 | 0.85 | NOTUM (0.39) | F11KLKB1CYP3A4 | |
| SCHEMBL30325632 | 0.84 | F11 (0.45) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL31174097 | 0.83 | F11 (0.38) | F11KLKB1CYP3A4KLK1 | |
| SCHEMBL31174118 | 0.82 | F11 (0.44) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL24633398 | 0.82 | F11 (0.44) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL31174078 | 0.82 | F11 (0.40) | F11KLKB1CYP3A4F2F10 | |
| SCHEMBL31252407 | 0.81 | F11 (0.44) | F11KLKB1CYP3A4F2F10 |
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 |