Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 5/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CCKBR | P32239 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1892100 | 0.86 | PPARG (0.39) | S1PR1CYP2C9 | |
| SCHEMBL4016374 | 0.84 | F10 (0.40) | CD274SMN1; SMN2 | |
| SCHEMBL4013365 | 0.83 | SMN1; SMN2 (0.40) | CD274SMN1; SMN2 | |
| SCHEMBL4313277 | 0.79 | CD274 (0.41) | CD274 | |
| SCHEMBL1892524 | 0.78 | AGTR1 (0.40) | — | |
| SCHEMBL1885801 | 0.77 | SLC33A1 (0.51) | — | |
| SCHEMBL4450943 | 0.77 | CYP3A4 (0.39) | CD274CYP2C9CYP1A2CYP3A4MAPT | |
| SCHEMBL1893662 | 0.76 | PPARG (0.39) | S1PR1CYP2C9 | |
| SCHEMBL1892613 | 0.75 | PPARG (0.38) | S1PR1CYP2C9 | |
| SCHEMBL1886447 | 0.75 | PPARG (0.39) | S1PR1CYP2C9 |
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-2074117-A2 | HETEROMONOCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008062905-A2 | HETEROMONOCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-05-29 | — | — | WO | disclosed |