Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1630686 | 0.85 | PDE10A (0.38) | PDE10ASMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL1630306 | 0.80 | ALDH1A1 (0.41) | ALDH1A1GAASMN1; SMN2HSP90AA1TDP1 | |
| SCHEMBL1628601 | 0.78 | MAPT (0.38) | GAAPDE10AHSP90AA1MAPTMEN1 | |
| SCHEMBL6448483 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TDP1NR3C2ACHEBACE1 | |
| SCHEMBL1630476 | 0.71 | MAPT (0.45) | ALDH1A1GAASMN1; SMN2HSP90AA1MAPT | |
| SCHEMBL1628898 | 0.70 | HSP90AA1 (0.40) | ALDH1A1PDE10ASMN1; SMN2HSP90AA1NR3C2 | |
| SCHEMBL1631632 | 0.70 | HSP90AA1 (0.39) | ALDH1A1GAAPDE10AHSP90AA1TDP1 | |
| SCHEMBL1631531 | 0.70 | HSP90AA1 (0.62) | PDE10ASMN1; SMN2HSP90AA1NR3C2MAPT | |
| SCHEMBL626539 | 0.67 | KCNN4 (0.55) | PDE10ASMN1; SMN2HSP90AA1NR3C2MAPT | |
| SCHEMBL1631441 | 0.67 | HSP90AA1 (0.43) | ALDH1A1GAASMN1; SMN2HSP90AA1TDP1 |
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-1776346-A1 | 1,5-DIPHENYLPYRAZOLES | Merck Patent GmbH (DE) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006018082-A1 | 1,5-DIPHENYLPYRAZOLES | MERCK PATENT GMBH (DE) | 2006-02-23 | — | — | WO | disclosed |