Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 6/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | SLC29A1 | Q99808 | 2/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11236182 | 0.86 | SERPINE1 (0.53) | SERPINE1KMT2AMEN1PKMSMN1; SMN2 | |
| SCHEMBL28583778 | 0.85 | ESR1 (0.63) | ESR1KMT2AAKR1C4AKR1C3AKR1C2 | |
| SCHEMBL22660277 | 0.83 | ESR1 (0.46) | SERPINE1ESR1SCN1ASCN2ASCN3A | |
| SCHEMBL18675963 | 0.83 | HDAC6 (0.48) | SERPINE1ESR1SCN1ASCN2ASCN3A | |
| SCHEMBL18675988 | 0.82 | PDE4B (0.47) | SERPINE1ESR1SCN1ASCN2ASCN3A | |
| SCHEMBL8641536 | 0.81 | KDM4E (0.55) | ESR1KMT2AMEN1PKMAKR1C4 | |
| SCHEMBL11679863 | 0.79 | KMT2A (0.46) | SERPINE1ESR1KMT2AMEN1PKM | |
| SCHEMBL14369822 | 0.79 | SERPINE1 (0.47) | SERPINE1ESR1KMT2AMEN1PKM | |
| SCHEMBL6940189 | 0.79 | ESR1 (0.65) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL5343528 | 0.78 | KMT2A (0.61) | SCN1ASCN2ASCN3AKMT2AMEN1 |
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-2020228635-A1 | EGFR KINASE INHIBITOR AND APPLICATION THEREOF IN PREPARING ANTI-CANCER DRUG | 浙江大学 | 2020-11-19 | — | — | WO | disclosed |