Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PLA2G4A | P47712 | 4/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | RBBP9 | O75884 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7377556 | 0.82 | ALDH1A1 (0.43) | ALDH1A1PLA2G4ACTSKHSPA9CES1 | |
| SCHEMBL7375810 | 0.81 | GSR (0.43) | ALDH1A1PLA2G4ACTSKCES1 | |
| SCHEMBL7950828 | 0.81 | ALDH1A1 (0.42) | ALDH1A1PLA2G4ACTSKCES1KMT2A | |
| Hydrochloric Acid SCHEMBL28172161 | 0.80 | PLA2G4A (0.40) | ALDH1A1PLA2G4ACTSKL3MBTL1CES1 | |
| SCHEMBL8800894 | 0.78 | ALDH1A1 (0.44) | ALDH1A1PLA2G4ACTSKHSPA9CES1 | |
| SCHEMBL27699627 | 0.73 | ALDH1A1 (0.50) | ALDH1A1PLA2G4AHSPA9CES1RBBP9 | |
| SCHEMBL7373336 | 0.73 | TBXAS1 (0.44) | — | |
| SCHEMBL7373337 | 0.73 | ARG1 (0.64) | ALDH1A1PLA2G4ACTSKCES1 | |
| SCHEMBL29469558 | 0.72 | ALDH1A1 (0.57) | ALDH1A1PLA2G4ACTSKHSPA9L3MBTL1 | |
| SCHEMBL7369196 | 0.71 | ALDH1A1 (0.45) | ALDH1A1PLA2G4AL3MBTL1HSD17B10CCNB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6057314-A | ANTICOAGULANTS | BIOCHEM PHARMA INC. (CA) | 2000-05-02 | — | — | US | disclosed |
| WO-1996019483-A1 | LOW MOLECULAR WEIGHT BICYCLIC THROMBIN INHIBITORS | BIOCHEM PHARMA INC. (CA) | 1996-06-27 | — | — | WO | disclosed |