Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | S100A4 | P26447 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28964573 | 0.81 | HSD17B10 (0.52) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL7900719 | 0.78 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL7900717 | 0.78 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL10976937 | 0.77 | HSD17B10 (0.50) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL18486454 | 0.75 | ALDH1A1 (0.50) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| Isobutane SCHEMBL27875598 | 0.74 | HSD17B10 (0.62) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL914901 | 0.73 | ALDH1A1 (0.48) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL10687125 | 0.73 | ALDH1A1 (0.47) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL31688378 | 0.73 | ALDH1A1 (0.48) | HSD17B10TDP1ALDH1A1TSHRMEN1 | |
| SCHEMBL642381 | 0.72 | KMT2A (0.39) | HSD17B10TDP1ALDH1A1MEN1KMT2A |
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-115677772-B | Compound and composition for EGFR kinase inhibitor and application thereof | 浙江大学智能创新药物研究院 | 2023-08-18 | — | — | CN | disclosed |