Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 7/20 | 0.46 |
| ▸ | BRAF | P15056 | 7/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | KIT | P10721 | 1/20 | 0.45 |
| ▸ | FLT1 | P17948 | 1/20 | 0.45 |
| ▸ | SCD | O00767 | 3/20 | 0.45 |
| ▸ | LCK | P06239 | 4/20 | 0.44 |
| ▸ | RIPK3 | Q9Y572 | 4/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2195849 | 0.94 | BRAF (0.51) | KDRBRAFAURKAPDGFRBKIT | |
| SCHEMBL2190583 | 0.89 | SCD (0.46) | KDRBRAFAURKAPDGFRBKIT | |
| SCHEMBL2190544 | 0.87 | BRAF (0.52) | KDRBRAFAURKAPDGFRBKIT | |
| SCHEMBL2193281 | 0.86 | RAB9A (0.44) | BRAFSCDLCK | |
| SCHEMBL2191802 | 0.85 | ALDH1A1 (0.52) | SCD | |
| SCHEMBL2192710 | 0.84 | KDR (0.59) | KDRBRAFAURKAPDGFRBKIT | |
| SCHEMBL2191884 | 0.83 | LCK (0.53) | KDRBRAFAURKAPDGFRBKIT | |
| SCHEMBL2851199 | 0.82 | KDR (0.52) | KDRBRAFPDGFRBKITFLT1 | |
| SCHEMBL2194440 | 0.81 | SCD (0.49) | KDRBRAFSCD | |
| SCHEMBL2191703 | 0.81 | BRAF (0.69) | KDRBRAFAURKAPDGFRBKIT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2181987-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-05-05 | — | — | EP | disclosed |