Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 8/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL587119 | 0.95 | SIGMAR1 (0.45) | SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL587171 | 0.91 | SIGMAR1 (0.42) | SIGMAR1TMEM97NPC1RAB9AALDH1A1 | |
| SCHEMBL586903 | 0.88 | SMN1; SMN2 (0.51) | SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL587054 | 0.87 | MAPK1 (0.36) | NPC1RAB9AALDH1A1 | |
| SCHEMBL586922 | 0.85 | ALDH1A1 (0.49) | SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL586771 | 0.83 | SIGMAR1 (0.43) | SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL582341 | 0.80 | SIGMAR1 (0.45) | SIGMAR1TMEM97HTT | |
| SCHEMBL2991986 | 0.76 | TMEM97 (0.51) | SIGMAR1TMEM97 | |
| SCHEMBL2991989 | 0.76 | TMEM97 (0.51) | SIGMAR1TMEM97 | |
| SCHEMBL586708 | 0.75 | ALDH1A1 (0.42) | NPC1RAB9ASMN1; SMN2ALDH1A1HTT |
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-2417131-A1 | ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS | AstraZeneca AB (SE) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010117323-A1 | METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE | ASTRAZENECA AB (SE) | 2010-10-14 | — | — | WO | disclosed |