Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25139530 | 0.82 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL10392909 | 0.82 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL10392904 | 0.79 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL8948117 | 0.78 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL474056 | 0.77 | ALDH1A1 (0.73) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL5171751 | 0.77 | ALDH1A1 (0.68) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL14741026 | 0.77 | ALDH1A1 (0.60) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL2818547 | 0.76 | ALDH1A1 (0.67) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL10393870 | 0.76 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4ELMNAKMT2A | |
| SCHEMBL474030 | 0.75 | ALDH1A1 (0.49) | ALDH1A1HPGDKDM4ELMNAKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5534517-A | (Aryl(alkyl)carbonyl)-heterocyclic compounds and their use in the treatment of anxiety and depression | ADIR ET COMPAGNIE (FR) | 1996-07-09 | — | — | US | disclosed |
| US-5387586-A | Analgesics, nervous system disorders | ADIR ET COMPAGNIE (FR) | 1995-02-07 | — | — | US | disclosed |
| EP-0613898-A1 | Aryl or arylalkyl-carbonyl heterocyclic derivatives, processes for their preparation and compositions containing them | ADIR ET COMPAGNIE (FR) | 1994-09-07 | — | — | EP | disclosed |