Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 8/20 | 0.61 |
| ▸ | RAF1 | P04049 | 4/20 | 0.61 |
| ▸ | FFAR1 | O14842 | 6/20 | 0.52 |
| ▸ | KDR | P35968 | 6/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.51 |
| ▸ | GNA15 | P30679 | 1/20 | 0.49 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | RET | P07949 | 2/20 | 0.48 |
| ▸ | CSF1R | P07333 | 1/20 | 0.48 |
| ▸ | PLK4 | O00444 | 1/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.48 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | LYN | P07948 | 1/20 | 0.48 |
| ▸ | ROS1 | P08922 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13547753 | 0.90 | BRAF (0.60) | BRAFRAF1FFAR1KDRRET | |
| SCHEMBL3543031 | 0.88 | BRAF (0.60) | BRAFRAF1FFAR1KDRFFAR4 | |
| SCHEMBL3550115 | 0.87 | BRAF (0.70) | BRAFRAF1FFAR1KDRRET | |
| SCHEMBL3986461 | 0.87 | BRAF (0.57) | BRAFRAF1KDRRETCSF1R | |
| SCHEMBL5781691 | 0.85 | KDR (0.55) | BRAFRAF1KDRRETCSF1R | |
| SCHEMBL29292082 | 0.85 | KDR (0.56) | BRAFRAF1KDRRETCSF1R | |
| SCHEMBL13603772 | 0.84 | KDR (0.54) | BRAFRAF1KDRRETCSF1R | |
| SCHEMBL3547494 | 0.83 | BRAF (0.68) | BRAFRAF1FFAR1KDRRET | |
| SCHEMBL3547173 | 0.82 | RAF1 (0.70) | BRAFRAF1KDRRETCSF1R | |
| SCHEMBL3544270 | 0.82 | RAF1 (0.70) | BRAFRAF1KDRRETCSF1R |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7652041-B2 | 4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridino-2-carboxamido: N-methyl-4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridine-2-carboxamide: Raf-kinase inhibitors | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2010-01-26 | — | — | US | disclosed |
| US-7652041-B2 | 4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridino-2-carboxamido: N-methyl-4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridine-2-carboxamide: Raf-kinase inhibitors | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2010-01-26 | — | — | US | disclosed |