Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 2/20 | 0.45 |
| ▸ | KDM1A | O60341 | 3/20 | 0.45 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.45 |
| ▸ | KDR | P35968 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.44 |
| ▸ | PRKCG | P05129 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | FES | P07332 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.44 |
| ▸ | ROS1 | P08922 | 1/20 | 0.44 |
| ▸ | FER | P16591 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 1/20 | 0.44 |
| ▸ | FLT4 | P35916 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1366386 | 1.00 | EPHX2 (0.47) | EPHX2ROCK1ROCK2BRAFKDM1A | |
| SCHEMBL1366968 | 0.87 | BRAF (0.50) | EPHX2ROCK1ROCK2BRAFKDR | |
| SCHEMBL4120001 | 0.87 | EPHX2 (0.46) | EPHX2ROCK1ROCK2BRAFKDM1A | |
| SCHEMBL12143169 | 0.83 | CDK8 (0.54) | ROCK1ROCK2BRAFKDRJAK2 | |
| SCHEMBL4128043 | 0.81 | KDR (0.63) | ROCK1ROCK2BRAFKDRJAK2 | |
| SCHEMBL29429732 | 0.81 | KDR (0.63) | ROCK1ROCK2BRAFKDRJAK2 | |
| SCHEMBL12143163 | 0.75 | PIK3CA (0.56) | ROCK1ROCK2BRAFKDRJAK2 | |
| SCHEMBL12143154 | 0.75 | KIT (0.59) | ROCK1ROCK2BRAFKDRMAP4K4 | |
| SCHEMBL1366384 | 0.75 | PIK3CA (0.50) | ROCK1ROCK2BRAFKDRMAP4K4 | |
| SCHEMBL1369008 | 0.75 | PIK3CA (0.50) | ROCK1ROCK2BRAFKDRMAP4K4 |
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-8067599-B2 | Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors | HOFFMAN-LA ROCHE INC. (US) | 2011-11-29 | — | — | US | disclosed |