Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNNI3K | Q59H18 | 17/20 | 0.49 |
| ▸ | BRAF | P15056 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL9986076 | 0.91 | TNNI3K (0.48) | TNNI3KBRAFKDM4EALDH1A1MAPT | |
| SCHEMBL9986304 | 0.88 | TNNI3K (0.52) | TNNI3KBRAFKDM4EALDH1A1MAPT | |
| SCHEMBL9987032 | 0.85 | TNNI3K (0.64) | TNNI3KBRAFKDM4EALDH1A1MAPT | |
| SCHEMBL9985718 | 0.82 | TNNI3K (0.61) | TNNI3KBRAFKDM4EALDH1A1MAPT | |
| SCHEMBL9986248 | 0.81 | TNNI3K (0.60) | TNNI3KBRAFMAPT | |
| SCHEMBL9986560 | 0.78 | TNNI3K (0.51) | TNNI3KBRAF | |
| SCHEMBL9986214 | 0.78 | TNNI3K (0.50) | TNNI3KBRAF | |
| SCHEMBL9985616 | 0.78 | TNNI3K (0.49) | TNNI3KBRAFKDM4EALDH1A1MAPT | |
| SCHEMBL9986382 | 0.78 | TNNI3K (0.42) | TNNI3KBRAF | |
| SCHEMBL9987092 | 0.78 | TNNI3K (0.47) | TNNI3KBRAF |
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-2011149827-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-12-01 | — | — | WO | claimed |