Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.72 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.72 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5342052 | 0.76 | CYP2C9 (0.59) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL7979351 | 0.74 | LMNA (0.80) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL15182464 | 0.70 | CYP2C19 (0.49) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL8112789 | 0.69 | ALDH1A1 (0.70) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL7981878 | 0.69 | LMNA (0.57) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL2826091 | 0.69 | NPSR1 (1.00) | LMNAALDH1A1KMT2AMEN1NPSR1 | |
| SCHEMBL10025787 | 0.66 | MAOA (0.62) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL5802956 | 0.66 | CYP1A2 (0.73) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL8802939 | 0.66 | LMNA (0.47) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL27448850 | 0.65 | ALDH1A1 (0.59) | LMNAALDH1A1KMT2AMEN1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0818448-B1 | Cycloalkano-pyridine as CETP inhibitors | BAYER AG (DE) | 2003-11-12 | — | — | EP | claimed |
| EP-0818448-A1 | Cycloalkano-pyridine as CETP inhibitors | BAYER AG (DE) | 1998-01-14 | — | — | EP | claimed |