Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 4/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | CTSG | P08311 | 1/20 | 0.35 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.35 |
| ▸ | CMA1 | P23946 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5574740 | 0.83 | CES1 (0.49) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL7911425 | 0.83 | CES1 (0.49) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL14932471 | 0.78 | CES1 (0.44) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL11098719 | 0.77 | ALDH1A1 (0.46) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL14932474 | 0.76 | CES1 (0.42) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL11522893 | 0.75 | MAPT (0.41) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL1255415 | 0.74 | LMNA (0.50) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL8663297 | 0.74 | CES1 (0.43) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL14790870 | 0.74 | CES1 (0.40) | CES1SRCALDH1A1MAPTCES2 | |
| SCHEMBL868096 | 0.73 | CES1 (0.51) | CES1SRCALDH1A1MAPTCES2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |