Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | PAK1 | Q13153 | 4/20 | 0.43 |
| ▸ | ITK | Q08881 | 2/20 | 0.42 |
| ▸ | PLK4 | O00444 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | PRKCG | P05129 | 1/20 | 0.42 |
| ▸ | INSR | P06213 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | FES | P07332 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | ROS1 | P08922 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.42 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.42 |
| ▸ | FER | P16591 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL857096 | 0.88 | PAK1 (0.53) | BRAFPAK1ITKPLK4AURKA | |
| SCHEMBL856153 | 0.87 | BRAF (0.52) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL855368 | 0.86 | BRAF (0.51) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL3506159 | 0.86 | BRAF (0.51) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL299382 | 0.86 | BRAF (0.51) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL413850 | 0.85 | BRAF (0.48) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL15677281 | 0.85 | BRAF (0.57) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL12467549 | 0.84 | BRAF (0.49) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL857305 | 0.83 | BRAF (0.54) | BRAFCYP2C9CYP3A4PAK1ITK | |
| SCHEMBL20408713 | 0.83 | CYP2C9 (0.58) | BRAFCYP2C9CYP3A4PAK1PLK4 |
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 |
|---|---|---|---|---|---|---|---|
| US-8143271-B2 | Compounds and methods for kinase modulation, and indications therefor | PLEXXIKON INC. (US) | 2012-03-27 | — | — | US | disclosed |