Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2579161 | 0.85 | GAA (0.48) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2584833 | 0.79 | NPC1 (0.44) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2584691 | 0.79 | ALDH1A1 (0.50) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2585373 | 0.77 | ALDH1A1 (0.54) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2582179 | 0.77 | RAB9A (0.47) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2588237 | 0.76 | SMN1; SMN2 (0.47) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL4264547 | 0.76 | KMT2A (0.48) | GAARAB9ANPC1ALDH1A1KMT2A | |
| SCHEMBL2585178 | 0.76 | ALDH1A1 (0.47) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2581639 | 0.76 | GAA (0.50) | GAARAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2585254 | 0.73 | POLB (0.44) | GAASMN1; SMN2ALDH1A1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| 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 | claimed |
| 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 |