Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EP300 | Q09472 | 2/20 | 0.34 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | TLK2 | Q86UE8 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6088079 | 1.00 | ALDH1A1 (0.35) | ALDH1A1TP53MEN1KMT2AHPGD | |
| SCHEMBL6089465 | 0.89 | JMJD6 (0.35) | ALDH1A1TP53MEN1KMT2AHPGD | |
| SCHEMBL6089458 | 0.89 | JMJD6 (0.35) | ALDH1A1TP53MEN1KMT2AHPGD | |
| SCHEMBL6088546 | 0.85 | ALDH1A1 (0.34) | ALDH1A1TP53MEN1KMT2AHPGD | |
| SCHEMBL6088550 | 0.85 | ALDH1A1 (0.34) | ALDH1A1TP53MEN1KMT2AHPGD | |
| SCHEMBL6089018 | 0.81 | PDPK1 (0.41) | TLK2LRRK2 | |
| SCHEMBL6089020 | 0.81 | PDPK1 (0.41) | TLK2LRRK2 | |
| SCHEMBL6090957 | 0.80 | KDR (0.38) | ALDH1A1MEN1KMT2AHPGDHSD17B10 | |
| SCHEMBL6090960 | 0.80 | KDR (0.38) | ALDH1A1MEN1KMT2AHPGDHSD17B10 | |
| SCHEMBL6089096 | 0.80 | FDFT1 (0.33) | ALDH1A1TP53MEN1KMT2AHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |