Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | BRAF | P15056 | 7/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4054055 | 0.78 | BRAF (0.49) | NPC1RAB9ABRAFKDRMAPK14 | |
| SCHEMBL4048461 | 0.75 | BRAF (0.49) | NPC1RAB9ABRAFKDRMAPK14 | |
| SCHEMBL4045295 | 0.75 | BRAF (0.46) | BRAFKDRMAPK14ALDH1A1LMNA | |
| SCHEMBL4055203 | 0.75 | BRAF (0.46) | BRAFKDRMAPK14ALDH1A1MAPT | |
| SCHEMBL4047106 | 0.74 | BRAF (0.51) | BRAFKDRMAPK14MAPTTDP1 | |
| SCHEMBL1017360 | 0.74 | BRAF (0.63) | BRAFKDRMAPK14MAPTTDP1 | |
| SCHEMBL1017008 | 0.70 | BRAF (0.63) | BRAFMAPK14MAPTTDP1 | |
| SCHEMBL1014169 | 0.70 | BRAF (0.68) | BRAFMAPK14LMNAL3MBTL1MAPT | |
| SCHEMBL1016856 | 0.69 | BRAF (0.63) | BRAFMAPK14MAPTTDP1 | |
| SCHEMBL1013380 | 0.69 | BRAF (1.00) | BRAF |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009108827-A1 | FUSED TRICYCLIC PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF | WYETH (US) | 2009-09-03 | — | — | WO | disclosed |