Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 3/20 | 0.55 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.55 |
| ▸ | PGR | P06401 | 2/20 | 0.49 |
| ▸ | CMA1 | P23946 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.38 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 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 | |
|---|---|---|---|---|
| SCHEMBL29895649 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL6190639 | 0.75 | POLB (0.56) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL29186754 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL20106905 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL1848968 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL6190902 | 0.75 | CMA1 (0.75) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL489133 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL435577 | 0.75 | PDE3B (0.59) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL118581 | 0.75 | PDE3B (0.55) | PDE3BPDE3APGRCMA1ALDH1A1 | |
| SCHEMBL14940358 | 0.72 | PDE3B (0.51) | PDE3BPDE3APGRCMA1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011137046-A1 | SUBSTITUTED 1,3-BENZOTHIAZOL-2(3H)-ONES AND [1,3]THIAZOLO[5,4-B]PYRIDIN-2(1H)-ONES AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | MERCK SHARP & DOHME CORP. (US) | 2011-11-03 | — | — | WO | disclosed |
| WO-2008132139-A2 | NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS | UCB PHARMA S.A. (BE) | 2008-11-06 | — | — | WO | disclosed |
| WO-2008132142-A2 | NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS | UCB PHARMA S.A. (BE) | 2008-11-06 | — | — | WO | disclosed |