Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | F11 | P03951 | 14/20 | 0.39 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.39 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 10/20 | 0.38 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.38 |
| ▸ | KLK1 | P06870 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21712731 | 0.85 | NOTUM (0.45) | NOTUMSCN9AF11CYP3A4KLKB1 | |
| SCHEMBL24633365 | 0.84 | F11 (0.43) | CNR1F11CYP3A4KLKB1 | |
| SCHEMBL30995011 | 0.84 | F11 (0.43) | CNR1F11CYP3A4KLKB1 | |
| SCHEMBL30271742 | 0.84 | NOTUM (0.42) | NOTUMF11CYP3A4KLKB1KCNMA1 | |
| SCHEMBL16971428 | 0.84 | NOTUM (0.42) | NOTUMF11CYP3A4KLKB1KCNMA1 | |
| SCHEMBL28509142 | 0.83 | F11 (0.46) | NOTUMF11CYP3A4KLKB1 | |
| SCHEMBL31174106 | 0.81 | NOTUM (0.47) | CNR1NOTUMF11PKN1PKN2 | |
| SCHEMBL31252194 | 0.79 | F11 (0.45) | F11CYP3A4KLKB1 | |
| SCHEMBL30995026 | 0.79 | F11 (0.44) | CNR1NOTUMSCN9AF11KLKB1 | |
| SCHEMBL24633397 | 0.79 | F11 (0.43) | F11CYP3A4KLKB1 |
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 |