Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 9/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PDE8B | O95263 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30782745 | 0.94 | HRH4 (0.40) | ADORA2AADORA1DHFRPIK3CA | |
| SCHEMBL4464801 | 0.78 | DHFR (0.42) | ADORA1DHFR | |
| SCHEMBL4457723 | 0.77 | HCAR2 (0.43) | ADORA2AADORA1DHFRPIK3CA | |
| SCHEMBL4077928 | 0.73 | NTRK1 (0.49) | — | |
| SCHEMBL4466340 | 0.73 | IGF1R (0.50) | ADORA2AADORA1 | |
| SCHEMBL3941063 | 0.73 | NTRK1 (0.52) | — | |
| SCHEMBL4473387 | 0.72 | DHFR (0.35) | DHFRPIK3CAPDE8B | |
| SCHEMBL23217059 | 0.72 | NTRK1 (0.52) | — | |
| SCHEMBL28664537 | 0.71 | MKNK1 (0.40) | ADORA2AADORA1DHFRPIK3CA | |
| SCHEMBL4470547 | 0.70 | CDC7 (0.33) | ADORA2AADORA1PDE8B |
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-2009017838-A2 | COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS | EXELIXIS, INC. (US) | 2009-02-05 | — | — | WO | claimed |