Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.46 |
| ▸ | RPS6KA4 | O75676 | 2/20 | 0.46 |
| ▸ | PRKACA | P17612 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | PRKX | P51817 | 2/20 | 0.46 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.46 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.46 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2585532 | 0.81 | HIF1A (0.52) | HIF1AROCK2ROCK1RPS6KA5PRKACA | |
| SCHEMBL2585707 | 0.80 | RAB9A (0.54) | HIF1AMAPK1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL2589522 | 0.78 | EPHX2 (0.56) | HIF1AROCK2RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL2586922 | 0.77 | HIF1A (0.72) | HIF1AROCK1RAB9A | |
| SCHEMBL2582356 | 0.73 | KMT2A (0.46) | HIF1AGSK3BRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL2589092 | 0.69 | HIF1A (0.43) | HIF1AROCK2GSK3B | |
| SCHEMBL2582407 | 0.69 | P2RX7 (0.54) | HIF1AROCK2CYP3A4 | |
| SCHEMBL2576273 | 0.68 | ALDH1A1 (0.48) | HIF1AMAPK1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL2585927 | 0.68 | WNT1 (0.46) | HIF1AMAPK1SMN1; SMN2 | |
| SCHEMBL2590019 | 0.68 | HIF1A (0.68) | HIF1ARAB9ASMN1; SMN2 |
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 |