Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 2/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.58 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | GBA1 | P04062 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CCR3 | P51677 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1836650 | 1.00 | FUCA1 (0.60) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL14986453 | 0.87 | FUCA1 (0.51) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL16740670 | 0.87 | FUCA1 (0.51) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL14986672 | 0.87 | FUCA1 (0.51) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL16714621 | 0.87 | FUCA1 (0.51) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL30014513 | 0.87 | FUCA1 (0.71) | FUCA1SIGMAR1S1PR1S1PR5GBA1 | |
| SCHEMBL4503331 | 0.84 | GBA1 (0.49) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL4506217 | 0.84 | GBA1 (0.49) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL500415 | 0.84 | GBA1 (0.49) | FUCA1SIGMAR1S1PR1S1PR5ACHE | |
| SCHEMBL4503332 | 0.84 | GBA1 (0.49) | FUCA1SIGMAR1S1PR1S1PR5ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114507215-B | Compound serving as PAK4 kinase inhibitor and preparation method and application thereof | 成都海博为药业有限公司 | 2024-09-13 | — | — | CN | disclosed |
| CN-114507215-A | Compound serving as PAK4 kinase inhibitor and preparation method and application thereof | 成都海博为药业有限公司 | 2022-05-17 | — | — | CN | disclosed |