Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | KIT | P10721 | 2/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | JAK1 | P23458 | 2/20 | 0.41 |
| ▸ | TYK2 | P29597 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | CHKA | P35790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6184315 | 0.82 | NR1H2 (0.56) | SCN9ANR1H2KDM4EALDH1A1POLB | |
| SCHEMBL29864787 | 0.81 | MET (0.54) | SCN9ANR1H2HTR7KITBRAF | |
| SCHEMBL30810382 | 0.77 | SCN9A (0.44) | SCN9ANR1H2KDM4EALDH1A1POLB | |
| SCHEMBL4878350 | 0.76 | HDAC3 (0.55) | KDM4EALDH1A1POLBPARP1PARP2 | |
| SCHEMBL24651118 | 0.76 | MGLL (0.49) | SCN9ANR1H2KDM4EALDH1A1POLB | |
| SCHEMBL30120919 | 0.76 | MGLL (0.49) | SCN9ANR1H2KDM4EALDH1A1POLB | |
| SCHEMBL29561815 | 0.74 | HTR6 (0.50) | SCN9AKDM4EALDH1A1BRAFPARP1 | |
| SCHEMBL1264281 | 0.73 | NR1H2 (0.62) | SCN9ANR1H2KDM4EALDH1A1POLB | |
| SCHEMBL3445946 | 0.73 | SCN9A (0.52) | SCN9AALDH1A1POLBMGLLABHD6 | |
| SCHEMBL24650637 | 0.73 | NR1H2 (0.57) | NR1H2KDM4EALDH1A1POLBHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022217821-A1 | ALKYNYLPHENYLBENZAMIDE COMPOUND AND USE THEREOF | 深圳市新樾生物科技有限公司 | 2022-10-20 | — | — | WO | disclosed |