Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL581073 | 0.94 | TSHR (0.36) | TP53GAATSHRRAB9AHSD17B10 | |
| SCHEMBL587449 | 0.94 | TP53 (0.41) | TP53SMN1; SMN2ALDH1A1GAAPOLB | |
| SCHEMBL582298 | 0.78 | NOTUM (0.32) | TSHRKDM4ELMNA | |
| SCHEMBL581244 | 0.74 | GAA (0.36) | ALDH1A1GAATSHRMAPTKDM4E | |
| SCHEMBL3074935 | 0.74 | GAA (0.36) | ALDH1A1GAATSHRMAPTKDM4E | |
| SCHEMBL580903 | 0.74 | GAA (0.36) | ALDH1A1GAATSHRMAPTKDM4E | |
| SCHEMBL582099 | 0.73 | TSHR (0.48) | TP53SMN1; SMN2GAATSHRMAPT | |
| SCHEMBL587349 | 0.73 | MMP1 (0.41) | — | |
| SCHEMBL587629 | 0.72 | ALDH1A1 (0.34) | SMN1; SMN2ALDH1A1MAPTNPSR1NPC1 | |
| SCHEMBL587099 | 0.72 | ALDH1A1 (0.34) | TP53SMN1; SMN2ALDH1A1MAPTNPSR1 |
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 |