Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22808762 | 0.77 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL20143281 | 0.76 | ALDH1A1 (0.63) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL14394180 | 0.76 | ALDH1A1 (0.63) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL7297834 | 0.76 | ALDH1A1 (0.63) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| E1501 SCHEMBL4106825 | 0.75 | ALDH1A1 (0.88) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL966323 | 0.75 | ALDH1A1 (0.62) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL6454059 | 0.75 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL602247 | 0.75 | ALDH1A1 (0.61) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL2111562 | 0.75 | ALDH1A1 (0.61) | ALDH1A1MAPTHPGDHCAR2TDP1 | |
| SCHEMBL602246 | 0.75 | ALDH1A1 (0.61) | ALDH1A1MAPTHPGDHCAR2TDP1 |
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-20040096211-A1 | Enantioselective reformatsky process for preparing optically active alcohols, amines and derivatives thereof | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH | 2004-05-20 | — | — | US | disclosed |