Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 16/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14138693 | 0.88 | BRAF (0.37) | BRAFGAAPKMKDM4EALDH1A1 | |
| SCHEMBL14138509 | 0.81 | BRAF (0.47) | BRAFPKM | |
| SCHEMBL14138812 | 0.72 | BRAF (0.42) | BRAFPKMMAOA | |
| SCHEMBL14138854 | 0.69 | BRAF (0.37) | BRAFPKM | |
| SCHEMBL3590961 | 0.68 | BRAF (0.63) | BRAFPKM | |
| SCHEMBL3598295 | 0.68 | BRAF (0.62) | BRAFPKM | |
| SCHEMBL14138573 | 0.67 | BRAF (0.41) | BRAFPKM | |
| SCHEMBL14138582 | 0.65 | BRAF (0.45) | BRAFPKMKDM4E | |
| SCHEMBL14138574 | 0.64 | BRAF (0.48) | BRAFPKM | |
| SCHEMBL14138579 | 0.63 | BRAF (0.46) | BRAFPKMKMT2A |
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-2008079277-A1 | CERTAIN PYRAZOLINE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2008-07-03 | — | — | WO | disclosed |