Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 13/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | LDHA | P00338 | 3/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.39 |
| ▸ | CIT | O14578 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.35 |
| ▸ | TLK2 | Q86UE8 | 1/20 | 0.35 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MYLK2 | Q9H1R3 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.35 |
| ▸ | STK39 | Q9UEW8 | 1/20 | 0.35 |
| ▸ | TLK1 | Q9UKI8 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17647428 | 1.00 | AAK1 (0.41) | AAK1FFAR4LDHACTSACIT | |
| SCHEMBL19440642 | 0.89 | NPC1 (0.43) | AAK1FFAR4LDHACTSACIT | |
| SCHEMBL17648799 | 0.87 | FFAR4 (0.41) | FFAR4LDHACTSAJAK2 | |
| SCHEMBL17646752 | 0.86 | LDHA (0.47) | FFAR4LDHACTSA | |
| SCHEMBL29862268 | 0.86 | LDHA (0.47) | FFAR4LDHACTSA | |
| SCHEMBL28490188 | 0.85 | FFAR4 (0.43) | AAK1FFAR4LDHACTSACIT | |
| SCHEMBL13053992 | 0.85 | NPC1 (0.39) | AAK1LDHASCN9AFPR2 | |
| SCHEMBL19412304 | 0.78 | FFAR4 (0.47) | FFAR4LDHACTSA | |
| SCHEMBL20633285 | 0.78 | FFAR4 (0.41) | FFAR4LDHACTSASCN9A | |
| SCHEMBL17648004 | 0.77 | EGFR (0.50) | FFAR4CTSASCN9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3436446-B1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMA (US) | 2023-06-07 | — | — | EP | disclosed |
| EP-4013759-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2022-06-22 | — | — | EP | disclosed |