Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7263800 | 0.92 | ALDH1A1 (0.56) | ALDH1A1HTTMAPTCES2SLC6A2 | |
| Methyl Alcohol SCHEMBL28215594 | 0.90 | ALDH1A1 (0.55) | ALDH1A1HTTMAPTCES2SLC6A2 | |
| SCHEMBL27726293 | 0.90 | ALDH1A1 (0.49) | ALDH1A1HTTMAPTCES2POLB | |
| Propionaldehyde SCHEMBL28746585 | 0.88 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTCES2SLC6A2 | |
| Monoethanolamine SCHEMBL27927512 | 0.86 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTCES2SLC6A2 | |
| SCHEMBL28075865 | 0.86 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTCES2POLB | |
| SCHEMBL28186277 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HTTMAPTCES2POLB | |
| SCHEMBL27473292 | 0.85 | CTSD (0.50) | ALDH1A1HTTMAPTPOLBTSHR | |
| SCHEMBL11298968 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HTTMAPTSLC6A2SLC6A3 | |
| Piperidine SCHEMBL27676223 | 0.81 | ALDH1A1 (0.49) | ALDH1A1HTTMAPTCES2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1291892-A | Substituted oxoazaheterocyclyl factor Xa inhibitors | AWENTIS PHARMACEUTICAL INC (US) | 2001-04-18 | — | — | CN | disclosed |