Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 16/20 | 0.47 |
| ▸ | CTSS | P25774 | 2/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29079141 | 0.90 | AAK1 (0.47) | AAK1CTSSCTSK | |
| SCHEMBL8905741 | 0.86 | TRPA1 (0.40) | AAK1CTSSCTSKTRPA1 | |
| SCHEMBL8905745 | 0.86 | TRPA1 (0.40) | AAK1CTSSCTSKTRPA1 | |
| SCHEMBL1562328 | 0.86 | TRPA1 (0.40) | AAK1CTSSCTSKTRPA1 | |
| SCHEMBL27534635 | 0.86 | TRPA1 (0.40) | AAK1CTSSCTSKTRPA1 | |
| SCHEMBL1562711 | 0.84 | PPARG (0.41) | AAK1TRPA1EGFR | |
| SCHEMBL7350485 | 0.83 | APP (0.41) | CTSSCTSKCTSBTRPA1 | |
| SCHEMBL8904987 | 0.83 | APP (0.41) | CTSSCTSKCTSBTRPA1 | |
| SCHEMBL8904990 | 0.83 | APP (0.41) | CTSSCTSKCTSBTRPA1 | |
| SCHEMBL1561376 | 0.83 | APP (0.41) | CTSSCTSKCTSBTRPA1 |
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-116640156-A | RIPK1 inhibitors | 上海齐鲁制药研究中心有限公司 | 2023-08-25 | — | — | CN | disclosed |