Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 4/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.38 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.38 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 3/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8967588 | 1.00 | CA2 (0.44) | CA2HRH3KDM4ELTA4HFAAH | |
| SCHEMBL8966731 | 0.98 | CA2 (0.41) | CA2HRH3KDM4ELTA4HFAAH | |
| SCHEMBL8967504 | 0.93 | HRH3 (0.41) | HRH3KDM4ELTA4HTHRATHRB | |
| SCHEMBL25926402 | 0.89 | CA2 (0.42) | CA2HRH3KDM4ELTA4HFAAH | |
| SCHEMBL27342847 | 0.83 | HRH3 (0.65) | HRH3ALDH1A1 | |
| SCHEMBL8967602 | 0.81 | SMN1; SMN2 (0.43) | HRH3ALDH1A1 | |
| SCHEMBL8967437 | 0.79 | HRH3 (0.54) | HRH3ALDH1A1 | |
| Sulfuric Acid SCHEMBL10335567 | 0.78 | HRH3 (0.58) | HRH3KDM4EGNAI3GNAO1GNAI1 | |
| Sulfuric Acid SCHEMBL9784580 | 0.78 | HRH3 (0.58) | HRH3KDM4EGNAI3GNAO1GNAI1 | |
| SCHEMBL22779191 | 0.78 | SMN1; SMN2 (0.40) | HRH3KDM4ETHRBALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0468434-B1 | Novel piperidyl ethers and thioethers as inhibitors of cholesterol biosynthesis | MERRELL DOW PHARMA (US) | 1996-02-28 | — | — | EP | disclosed |
| US-5348964-A | Anticholesterol agents or fungicides | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-09-20 | — | — | US | disclosed |
| CN-1058399-A | New piperidine ether and thioether as cholesteral biosynthesis inhibitor | MERRELL DOW PHARMA (US) | 1992-02-05 | — | — | CN | disclosed |
| EP-0468434-A1 | Novel piperidyl ethers and thioethers as inhibitors of cholesterol biosynthesis | MERRELL PHARMACEUTICALS INC. (US) | 1992-01-29 | — | — | EP | disclosed |