Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 10/20 | 0.45 |
| ▸ | AURKA | O14965 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NNMT | P40261 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 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 | |
|---|---|---|---|---|
| SCHEMBL29638494 | 0.80 | PARP1 (0.51) | PARP1RPS6KB1AURKANNMT | |
| SCHEMBL29638622 | 0.78 | PARP1 (0.44) | PARP1RPS6KB1AURKA | |
| SCHEMBL27789401 | 0.78 | PARP1 (0.48) | PARP1EGFRRPS6KB1AURKAKDM4E | |
| SCHEMBL29923698 | 0.77 | PARP1 (0.58) | PARP1EGFRKDM4E | |
| SCHEMBL20515224 | 0.77 | PARP1 (0.58) | PARP1EGFRKDM4E | |
| SCHEMBL1325275 | 0.76 | EGFR (0.51) | EGFRCYP11B1CYP11B2 | |
| SCHEMBL15544783 | 0.74 | PARP1 (0.41) | PARP1RPS6KB1 | |
| SCHEMBL30509874 | 0.73 | NNMT (0.45) | PARP1RPS6KB1KDM4ENNMT | |
| SCHEMBL31582882 | 0.73 | NNMT (0.45) | PARP1RPS6KB1KDM4ENNMT | |
| SCHEMBL27830076 | 0.72 | ALDH1A1 (0.47) | PARP1RPS6KB1AURKAKDM4E |
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-2022089219-A1 | ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2022-05-05 | — | — | WO | disclosed |