Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 9/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10262734 | 0.89 | P2RX3 (0.44) | BRAFMAPK14P2RX3JAK2JAK1 | |
| SCHEMBL5430266 | 0.87 | KDR (0.55) | BRAFMAPK14KDRHDAC3HDAC4 | |
| SCHEMBL10263998 | 0.78 | KDR (0.55) | BRAFKDR | |
| SCHEMBL10262556 | 0.76 | AXL (0.41) | BRAFMAPK14KDRHDAC3HDAC4 | |
| SCHEMBL10263025 | 0.76 | MEN1 (0.44) | BRAFMAPK14JAK2JAK1TYK2 | |
| SCHEMBL546771 | 0.75 | BRAF (0.57) | BRAFMAPK14KDRHDAC3HDAC4 | |
| SCHEMBL10263595 | 0.73 | BRAF (0.63) | BRAFMAPK14KDRRAF1 | |
| SCHEMBL10267992 | 0.73 | BRAF (0.46) | BRAFMAPK14P2RX3KDRRAF1 | |
| SCHEMBL5418586 | 0.70 | RAF1 (0.51) | BRAFMAPK14KDRRAF1 | |
| SCHEMBL546218 | 0.70 | BRAF (0.48) | BRAFMAPK14KDRHDAC3HDAC4 |
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-8110687-B2 | Bicyclic compounds with kinase inhibitory activity | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-07 | — | — | US | disclosed |