Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 9/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | PLA2G7 | Q13093 | 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 | |
|---|---|---|---|---|
| SCHEMBL24310230 | 1.00 | TDP1 (0.42) | TDP1SCN9ACYP2C9FBP1LMNA | |
| SCHEMBL24310082 | 0.91 | ALPL (0.42) | TDP1SCN9ALMNAHTTALDH1A1 | |
| SCHEMBL29566627 | 0.91 | ALPL (0.42) | TDP1SCN9ALMNAHTTALDH1A1 | |
| SCHEMBL29567008 | 0.88 | TDP1 (0.45) | TDP1SCN9ALMNAHTTBRD4 | |
| SCHEMBL24309354 | 0.88 | TDP1 (0.45) | TDP1SCN9ALMNAHTTBRD4 | |
| SCHEMBL24310800 | 0.88 | TDP1 (0.42) | TDP1SCN9ALMNAHTTBRD4 | |
| SCHEMBL29567109 | 0.88 | TDP1 (0.42) | TDP1SCN9ALMNAHTTBRD4 | |
| SCHEMBL24310091 | 0.87 | TDP1 (0.41) | TDP1SCN9ALMNAHTTBRD4 | |
| SCHEMBL29566464 | 0.87 | KDM1A (0.45) | TDP1LMNAHTTDRD2HTR1A | |
| SCHEMBL29567206 | 0.87 | TDP1 (0.41) | TDP1SCN9ALMNAHTTBRD4 |
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-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |