Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 7/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CCR9 | P51686 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10049570 | 0.71 | KMO (0.44) | KMOHTR2AHTR2C | |
| SCHEMBL29411862 | 0.70 | FGFR1 (0.42) | KMOHTR2AHTR2C | |
| SCHEMBL3632921 | 0.70 | FGFR1 (0.42) | KMOHTR2AHTR2C | |
| SCHEMBL17846395 | 0.70 | MAPK1 (0.48) | KMOHTR2AHTR2C | |
| SCHEMBL29796402 | 0.69 | RECQL (0.56) | KMO | |
| SCHEMBL12535873 | 0.68 | TRPM5 (0.43) | HTR2AHTR2CCCR9 | |
| SCHEMBL29864422 | 0.68 | DGAT1 (0.35) | HTR2AHTR2C | |
| SCHEMBL17847964 | 0.67 | CCR9 (0.39) | KMOCCR9 | |
| SCHEMBL27856881 | 0.66 | CCR9 (0.38) | KMOCCR9 | |
| SCHEMBL29545233 | 0.66 | CHEK1 (0.54) | KMOHTR2AHTR2CCCR9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2379513-A1 | HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010078408-A1 | HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS | BIOGEN IDEC MA INC. (US) | 2010-07-08 | — | — | WO | disclosed |