Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 11/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 9/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4011619 | 0.89 | AGTR1 (0.42) | PPARGAGTR1AGTR2 | |
| SCHEMBL1889960 | 0.88 | PPARG (0.40) | PPARGAGTR1AGTR2GRIN1GRIN2B | |
| SCHEMBL4012714 | 0.88 | PPARG (0.51) | PPARGAGTR1AGTR2 | |
| SCHEMBL4008828 | 0.81 | AGTR1 (0.42) | PPARGAGTR1AGTR2GRIN1GRIN2B | |
| SCHEMBL4010302 | 0.81 | PPARG (0.50) | PPARGAGTR1 | |
| SCHEMBL4010555 | 0.81 | PPARG (0.38) | PPARGAGTR1AGTR2GRIN1GRIN2B | |
| SCHEMBL4019464 | 0.80 | PPARG (0.54) | PPARGAGTR1AGTR2 | |
| SCHEMBL2842851 | 0.78 | AGTR1 (0.44) | PPARGAGTR1AGTR2 | |
| SCHEMBL4308395 | 0.77 | PPARG (0.49) | PPARG | |
| SCHEMBL4016615 | 0.77 | PPARG (0.54) | PPARGAGTR1AGTR2 |
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 |