Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.64 |
| ▸ | CA1 | P00915 | 5/20 | 0.64 |
| ▸ | CA2 | P00918 | 5/20 | 0.64 |
| ▸ | CA6 | P23280 | 4/20 | 0.64 |
| ▸ | CA7 | P43166 | 4/20 | 0.64 |
| ▸ | CA9 | Q16790 | 4/20 | 0.64 |
| ▸ | CA13 | Q8N1Q1 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.60 |
| ▸ | HPGD | P15428 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204847 | 0.83 | ALDH1A1 (0.74) | ALDH1A1HPGDSMN1; SMN2HSD17B10HDAC3 | |
| SCHEMBL10979012 | 0.79 | PTGES (0.61) | CA12CA1CA2CA6CA7 | |
| SCHEMBL22380997 | 0.78 | CA2 (1.00) | CA12CA1CA2CA6CA7 | |
| SCHEMBL18805093 | 0.78 | ALPG (0.65) | CA12CA1CA2CA6CA7 | |
| SCHEMBL3181896 | 0.77 | HDAC3 (0.68) | CA1CA2CA7CA13ALDH1A1 | |
| SCHEMBL9787308 | 0.76 | CA1 (0.62) | CA1CA2CA7CA13ALDH1A1 | |
| SCHEMBL1983060 | 0.74 | HDAC1 (0.76) | CA1CA2ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL17165792 | 0.73 | ALDH1A1 (0.53) | CA12CA1CA2ALDH1A1HPGD | |
| SCHEMBL6320487 | 0.73 | ALDH1A1 (1.00) | ALDH1A1HPGDSMN1; SMN2HSD17B10NPC1 | |
| SCHEMBL9787305 | 0.72 | SMN1; SMN2 (0.58) | CA1CA2CA7CA13ALDH1A1 |
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 |