Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 7/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2585707 | 0.84 | RAB9A (0.54) | HIF1ACYP1A2CYP2C19 | |
| SCHEMBL2584587 | 0.82 | ROCK2 (0.48) | P2RX7ROCK2HIF1ATP53CYP1A2 | |
| SCHEMBL2589522 | 0.80 | EPHX2 (0.56) | ROCK2HIF1A | |
| SCHEMBL2585532 | 0.76 | HIF1A (0.52) | ROCK2HIF1ATP53CYP1A2CYP2C19 | |
| SCHEMBL2581145 | 0.76 | TSHR (0.50) | P2RX7ROCK2TP53 | |
| SCHEMBL2576273 | 0.75 | ALDH1A1 (0.48) | HIF1ATP53 | |
| SCHEMBL2585927 | 0.75 | WNT1 (0.46) | HIF1ACYP1A2 | |
| SCHEMBL1568227 | 0.74 | HIF1A (0.72) | P2RX7ROCK2HIF1ATP53RIPK1 | |
| SCHEMBL1475037 | 0.74 | HIF1A (0.62) | HIF1A | |
| SCHEMBL2586722 | 0.73 | WNT1 (0.49) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8048879-B2 | Substituted 4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridine compounds and use thereof for producing medicaments | GRUENENTHAL GMBH (DE) | 2011-11-01 | — | — | US | disclosed |