Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL18985960 | 0.87 | TBK1 (0.60) | CYP3A4TBK1 | |
| SCHEMBL8230514 | 0.85 | CYP3A4 (0.56) | CYP3A4TBK1 | |
| SCHEMBL13390974 | 0.85 | CYP3A4 (0.56) | CYP3A4 | |
| SCHEMBL14456910 | 0.85 | CYP3A4 (0.54) | CYP3A4 | |
| SCHEMBL14456944 | 0.85 | MEN1 (0.59) | CYP3A4TBK1 | |
| SCHEMBL14456908 | 0.84 | CYP3A4 (0.54) | CYP3A4TBK1 | |
| SCHEMBL14456909 | 0.84 | CYP3A4 (0.53) | CYP3A4TBK1 | |
| SCHEMBL13003570 | 0.84 | CYP3A4 (0.55) | CYP3A4 | |
| SCHEMBL14456717 | 0.84 | ADRB2 (0.62) | L3MBTL1CYP3A4KDM4EALDH1A1 | |
| SCHEMBL14457005 | 0.84 | CYP3A4 (0.51) | CYP3A4ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7238688-B2 | Piperidine compounds | SCHERING CORPORATION (US) | 2007-07-03 | — | — | US | disclosed |
| US-7238688-B2 | Piperidine compounds | SCHERING CORPORATION (US) | 2007-07-03 | — | — | US | disclosed |