Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 3/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | S100A9 | P06702 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | BPTF | Q12830 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL30833643 | 0.88 | ALK (0.43) | TRPV1AURKAAURKBALKCDK7 | |
| SCHEMBL30833796 | 0.85 | IGF1R (0.46) | TRPV1AURKAAURKBMEN1KMT2A | |
| SCHEMBL30833765 | 0.85 | PKMYT1 (0.38) | PIN1TRPV1S100A9AURKAAURKB | |
| SCHEMBL30833659 | 0.85 | AURKA (0.48) | TRPV1AURKAAURKBMAPTTP53 | |
| SCHEMBL30833703 | 0.82 | TRPV1 (0.47) | TRPV1AURKBYTHDC1CDK7CDK9 | |
| SCHEMBL30833645 | 0.78 | PIN1 (0.36) | PIN1MAPTYTHDC1MEN1KMT2A | |
| SCHEMBL30833663 | 0.78 | PIN1 (0.36) | PIN1MAPTYTHDC1MEN1KMT2A | |
| SCHEMBL22807434 | 0.76 | EGFR (0.42) | PIN1MAPTTP53MEN1KMT2A | |
| SCHEMBL30833629 | 0.76 | EGFR (0.42) | PIN1MAPTTP53MEN1KMT2A | |
| SCHEMBL29549370 | 0.76 | EGFR (0.42) | PIN1MAPTTP53MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |