Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNNI3K | Q59H18 | 11/20 | 0.41 |
| ▸ | BRAF | P15056 | 6/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
| ▸ | GAK | O14976 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL589246 | 1.00 | TNNI3K (0.41) | TNNI3KBRAFPARP1KDRPAK1 | |
| SCHEMBL588579 | 0.92 | KDR (0.36) | TNNI3KPARP1KDRPAK1MAP2K4 | |
| SCHEMBL31672566 | 0.92 | KDR (0.41) | PARP1KDRPAK1 | |
| SCHEMBL10151145 | 0.92 | KDR (0.41) | PARP1KDRPAK1 | |
| SCHEMBL31672412 | 0.90 | ALK (0.39) | PARP1KDRPAK1 | |
| SCHEMBL2877867 | 0.90 | ALK (0.39) | PARP1KDRPAK1 | |
| SCHEMBL30453279 | 0.85 | LRRK2 (0.38) | KDRPAK1LRRK2 | |
| SCHEMBL589240 | 0.85 | LRRK2 (0.38) | KDRPAK1LRRK2 | |
| SCHEMBL589264 | 0.85 | KDR (0.46) | TNNI3KBRAFPARP1KDRMAP2K4 | |
| SCHEMBL30453307 | 0.85 | KDR (0.46) | TNNI3KBRAFPARP1KDRMAP2K4 |
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-113181362-B | Medicament for preventing and/or treating amyotrophic lateral sclerosis | 国立大学法人京都大学 | 2023-06-13 | — | — | CN | disclosed |