Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7978744 | 0.82 | ACHE (0.41) | ALDH1A1ERN1 | |
| SCHEMBL9007960 | 0.75 | ACHE (0.36) | ALDH1A1PDE3BPDE3APDGFRBPDGFRA | |
| SCHEMBL3383561 | 0.73 | NQO2 (0.46) | ALDH1A1PDE3BPDE3ACA12CA1 | |
| SCHEMBL7577367 | 0.71 | LMNA (0.37) | PARP15PARP10TNKS2PARP2ALDH1A1 | |
| SCHEMBL2160767 | 0.69 | RAB9A (0.43) | ALDH1A1PDE3BPDE3ACYP1A2CYP3A4 | |
| SCHEMBL22132817 | 0.69 | PDGFRB (0.39) | PARP15PARP10TNKS2PARP2ALDH1A1 | |
| SCHEMBL7575561 | 0.68 | NQO2 (0.39) | ALDH1A1PDGFRBPDGFRACYP3A4KDM4E | |
| SCHEMBL10586695 | 0.67 | CYP3A4 (0.50) | PARP15PARP10TNKS2PARP2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10585624 | 0.66 | CYP3A4 (0.49) | PARP15PARP10TNKS2PARP2ALDH1A1 | |
| Bromide SCHEMBL10584554 | 0.66 | CYP3A4 (0.49) | PARP15PARP10TNKS2PARP2ALDH1A1 |
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-0882730-B1 | PHOSPHONIC ACID DIESTER DERIVATIVES | OTSUKA PHARMA CO LTD (JP) | 2002-10-02 | — | — | EP | disclosed |
| US-5985858-A | TREATING AND PREVENTING HYPERLIPIDEMIA, DIABETES AND CATARACT, OR AS AN ANTITUMOR AGENT | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1999-11-16 | — | — | US | disclosed |
| EP-0882730-A1 | PHOSPHONIC ACID DIESTER DERIVATIVES | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1998-12-09 | — | — | EP | disclosed |