Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11040665 | 0.92 | GAA (0.39) | ACHEHSD17B10GAAALDH1A1MAPT | |
| SCHEMBL9337987 | 0.82 | ACHE (0.43) | ACHEHSD17B10GAAALDH1A1MAPT | |
| SCHEMBL2461330 | 0.81 | IGF1R (0.37) | ALDH1A1MAPTATMLMNAGSR | |
| SCHEMBL6258107 | 0.81 | ALDH1A1 (0.53) | ACHEHSD17B10ALDH1A1MAPTMAPK1 | |
| SCHEMBL2461283 | 0.81 | IGF1R (0.37) | ALDH1A1MAPTATMLMNAGSR | |
| SCHEMBL28306985 | 0.81 | ALDH1A1 (0.42) | HSD17B10ALDH1A1MAPTHSP90AA1MAPK1 | |
| SCHEMBL3336779 | 0.80 | GSR (0.55) | ALDH1A1MAPTMAPK1NPSR1TDP1 | |
| Fluoride SCHEMBL28046654 | 0.78 | GSR (0.53) | ALDH1A1MAPTMAPK1NPSR1TDP1 | |
| SCHEMBL4269735 | 0.78 | MAPT (0.41) | ACHEHSD17B10GAAALDH1A1MAPT | |
| SCHEMBL11043092 | 0.75 | GSR (0.46) | ALDH1A1MAPTMAPK1NPSR1TDP1 |
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-1765793-A1 | CETP INHIBITORS | Merck and Co., Inc. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2006014357-A1 | CETP INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | disclosed |
| WO-2006014413-A1 | CETP INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | disclosed |