Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 4/20 | 0.52 |
| ▸ | AURKA | O14965 | 13/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.46 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28622783 | 0.88 | AURKA (0.44) | RETAURKAAURKBRIPK1IGF1R | |
| SCHEMBL21744548 | 0.84 | RET (0.54) | RETIGF1R | |
| SCHEMBL22546705 | 0.82 | RET (0.47) | RETAURKAAURKBRIPK1IGF1R | |
| SCHEMBL18153425 | 0.82 | GALR2 (0.53) | — | |
| SCHEMBL28462357 | 0.82 | IGF1R (0.53) | RETAURKAAURKBIGF1R | |
| SCHEMBL31465821 | 0.80 | RET (0.49) | RET | |
| SCHEMBL24409358 | 0.79 | RET (0.55) | RET | |
| SCHEMBL1704773 | 0.78 | KARS1 (0.51) | RET | |
| SCHEMBL28618614 | 0.77 | RET (0.56) | RETAURKAAURKBEGFR | |
| SCHEMBL26457747 | 0.77 | AURKA (0.73) | RETAURKAAURKBRIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020156319-A1 | N-FORMAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 浙江海正药业股份有限公司 | 2020-08-06 | — | — | WO | disclosed |
| WO-2020035065-A1 | PYRAZOLE DERIVATIVE AS RET INHIBITOR | 南京明德新药研发有限公司 | 2020-02-20 | — | — | WO | disclosed |