Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18556218 | 0.79 | ALDH1A1 (0.41) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL1421071 | 0.76 | L3MBTL1 (0.42) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL31258481 | 0.75 | ALDH1A1 (0.38) | ALDH1A1POLBL3MBTL1ATMMAPT | |
| SCHEMBL22031687 | 0.75 | ALDH1A1 (0.38) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL3943182 | 0.75 | MMP1 (0.39) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL29141676 | 0.73 | ALDH1A1 (0.35) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL29124849 | 0.72 | ALDH1A1 (0.45) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL3399580 | 0.72 | ALDH1A1 (0.45) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL18399339 | 0.72 | ALDH1A1 (0.42) | ALDH1A1POLBL3MBTL1THRBATM | |
| SCHEMBL4788827 | 0.71 | CA12 (0.45) | ALDH1A1POLBL3MBTL1MAPTSMN1; SMN2 |
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-2536710-A2 | PIPERIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2012-12-26 | — | — | EP | disclosed |
| WO-2011101304-A2 | PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-08-25 | — | — | WO | disclosed |