Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.74 |
| ▸ | NPC1 | O15118 | 7/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.74 |
| ▸ | HPGD | P15428 | 2/20 | 0.74 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.74 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.74 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6204847 | 0.85 | ALDH1A1 (0.74) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL9787323 | 0.80 | ALDH1A1 (0.71) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL11710565 | 0.77 | KMT2A (0.61) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL10874649 | 0.76 | NPC1 (0.65) | RAB9ANPC1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL674213 | 0.75 | ALDH1A1 (0.50) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL1770039 | 0.75 | ALDH1A1 (0.53) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL437152 | 0.75 | ALDH1A1 (0.69) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL29987569 | 0.75 | ALDH1A1 (0.69) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL12417248 | 0.74 | ALDH1A1 (0.80) | RAB9ANPC1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL5717736 | 0.74 | KMT2A (0.61) | RAB9ANPC1ALDH1A1SMN1; SMN2HPGD |
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 |