Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | ELANE | P08246 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | F2 | P00734 | 2/20 | 0.32 |
| ▸ | PLAU | P00749 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23905478 | 0.83 | ELANE (0.38) | EGFRKDM4EMAPTNPSR1ELANE | |
| SCHEMBL1663399 | 0.71 | ELANE (0.40) | EGFRKDM4EMAPTNPSR1ELANE | |
| SCHEMBL29277951 | 0.70 | KDM4E (0.39) | EGFRKDM4EMAPTNPSR1ELANE | |
| SCHEMBL31309441 | 0.69 | KDM4C (0.40) | KDM4EMAPTNPSR1ALDH1A1GAA | |
| SCHEMBL3686647 | 0.69 | EGFR (0.40) | EGFRKDM4EMAPTNPSR1ELANE | |
| SCHEMBL1662907 | 0.69 | ALDH1A1 (0.48) | KDM4EMAPTALDH1A1GAAHPGD | |
| SCHEMBL1664597 | 0.68 | ALDH1A1 (0.43) | EGFRKDM4EMAPTALDH1A1GAA | |
| SCHEMBL1663371 | 0.67 | EGFR (0.43) | EGFRKDM4EMAPTNPSR1ALDH1A1 | |
| SCHEMBL1662993 | 0.67 | ALDH1A1 (0.47) | EGFRKDM4EMAPTELANEALDH1A1 | |
| SCHEMBL1663705 | 0.66 | SPR (0.34) | EGFRKDM4EMAPTNPSR1ELANE |
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-2021198981-A1 | ANTIVIRAL COMPOUNDS AND USES THEREOF | Janssen Biopharma, Inc. (US) | 2021-10-07 | — | — | WO | disclosed |