Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CD44 | P16070 | 1/20 | 0.34 |
| ▸ | HTR5A | P47898 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1172224 | 0.80 | BACE1 (0.32) | HTR5A | |
| SCHEMBL1172152 | 0.80 | TAAR1 (0.39) | HTR5A | |
| SCHEMBL4462368 | 0.80 | HTR5A (0.32) | HTR5A | |
| SCHEMBL30157203 | 0.77 | JAK2 (0.31) | HTR5A | |
| SCHEMBL1172351 | 0.75 | BACE1 (0.38) | — | |
| SCHEMBL4454878 | 0.75 | GAA (0.40) | — | |
| SCHEMBL4459737 | 0.73 | BACE1 (0.38) | NPSR1 | |
| SCHEMBL1171691 | 0.72 | BACE1 (0.41) | — | |
| SCHEMBL29974839 | 0.71 | HTT (0.31) | — | |
| SCHEMBL4459245 | 0.71 | BACE1 (0.31) | — |
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 | disclosed |