Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.37 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.37 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.37 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4749498 | 0.85 | ACACB (0.54) | DAOADORA2AACACBALDH1A1HPGD | |
| SCHEMBL15173772 | 0.83 | ADORA2A (0.44) | DAOADORA2ARAB9ANPC1NAMPT | |
| SCHEMBL5779927 | 0.80 | ALDH1A1 (0.44) | ACACBRAB9ANPC1ALDH1A1 | |
| SCHEMBL3633129 | 0.79 | APLNR (0.46) | RAB9ANPC1ALDH1A1PLAAT3PLAAT5 | |
| SCHEMBL2846343 | 0.78 | HIF1A (0.56) | RAB9ANPC1ALDH1A1 | |
| SCHEMBL29009736 | 0.77 | FFAR1 (0.55) | DAOHTR2AHTR2CKCNH2ALDH1A1 | |
| SCHEMBL29404687 | 0.77 | FFAR1 (0.55) | DAOHTR2AHTR2CKCNH2ALDH1A1 | |
| SCHEMBL3937280 | 0.75 | FFAR1 (0.45) | DAOHTR2AHTR2CKCNH2 | |
| SCHEMBL14485788 | 0.74 | HCAR3 (0.47) | ALDH1A1 | |
| SCHEMBL30941107 | 0.73 | NPC1 (0.62) | RAB9ANPC1ALDH1A1PLAAT3PLAAT5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2152702-A1 | AMINO-THIAZOLYL- PYRIMIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER | AstraZeneca AB (SE) | 2010-02-17 | — | — | EP | disclosed |
| WO-2009013545-A2 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2009-01-29 | — | — | WO | disclosed |
| WO-2008135786-A1 | AMINO-THIAZOLYL- PYRIMIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2008-11-13 | — | — | WO | disclosed |