Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.74 |
| ▸ | RAB9A | P51151 | 6/20 | 0.74 |
| ▸ | NPC1 | O15118 | 5/20 | 0.74 |
| ▸ | HPGD | P15428 | 4/20 | 0.74 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.74 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6201522 | 0.85 | RAB9A (0.74) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL6201829 | 0.83 | CA12 (0.64) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL9787323 | 0.80 | ALDH1A1 (0.71) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL6937212 | 0.76 | TLR7 (0.49) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL9787308 | 0.76 | CA1 (0.62) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL29987569 | 0.75 | ALDH1A1 (0.69) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL437152 | 0.75 | ALDH1A1 (0.69) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL13461017 | 0.74 | LMNA (0.64) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL11710565 | 0.74 | KMT2A (0.61) | ALDH1A1RAB9ANPC1HPGDHSD17B10 | |
| SCHEMBL5717736 | 0.74 | KMT2A (0.61) | ALDH1A1RAB9ANPC1HPGDHSD17B10 |
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 |