Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.60 |
| ▸ | MLYCD | O95822 | 9/20 | 0.50 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.48 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.48 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.48 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.48 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Terephthalamide SCHEMBL30182529 | 0.83 | PARP1 (0.56) | CES1PARP10PARP4ALDH1A1KMT2A | |
| SCHEMBL1851024 | 0.81 | CES1 (0.60) | CES1MLYCDKMT2APOLBTDP1 | |
| SCHEMBL19056956 | 0.80 | CES1 (0.65) | CES1MLYCDTRPV1 | |
| Hydrochloric Acid SCHEMBL28253028 | 0.79 | CES1 (0.58) | CES1MLYCDKMT2APOLBTDP1 | |
| Terephthalamide SCHEMBL23774 | 0.79 | PARP1 (0.71) | PARP10PARP4ALDH1A1KMT2APARP15 | |
| SCHEMBL16823 | 0.78 | CES1 (0.62) | CES1MLYCDTRPV1CA2CA1 | |
| SCHEMBL2174033 | 0.78 | CES1 (0.62) | CES1MLYCDMAPTTRPV1CA2 | |
| SCHEMBL1421656 | 0.78 | CES1 (0.70) | CES1MLYCDALDH1A1TSHRCA2 | |
| SCHEMBL4263903 | 0.77 | PARP10 (0.45) | PARP10PARP4ALDH1A1KMT2APARP15 | |
| SCHEMBL29177238 | 0.77 | KIF11 (0.56) | CES1MLYCDPARP10PARP4ALDH1A1 |
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-4405344-A2 | PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS | Xenon Pharmaceuticals Inc. (CA) | 2024-07-31 | — | — | EP | disclosed |
| WO-2023049369-A2 | PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS | XENON PHARMACEUTICALS INC. (CA) | 2023-03-30 | — | — | WO | disclosed |