Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21754357 | 1.00 | CYP2C19 (0.49) | CYP2C19ALDH1A1CYP1A2ACHEKDM4E | |
| SCHEMBL7485644 | 1.00 | CYP2C19 (0.49) | CYP2C19ALDH1A1CYP1A2ACHEKDM4E | |
| SCHEMBL25225372 | 0.87 | ALDH1A1 (0.46) | CYP2C19ALDH1A1CYP1A2ACHEKDM4E | |
| SCHEMBL29187355 | 0.84 | PTPRC (0.51) | CYP2C19ALDH1A1CYP1A2KDM4EHTT | |
| SCHEMBL25272208 | 0.84 | ACHE (0.40) | CYP2C19ALDH1A1CYP1A2ACHEKDM4E | |
| SCHEMBL25690136 | 0.81 | ALDH1A1 (0.46) | CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL8204533 | 0.77 | CYP2D6 (0.49) | CYP2C19ALDH1A1CYP1A2ACHEKDM4E | |
| SCHEMBL23519692 | 0.75 | ALDH1A1 (0.55) | CYP2C19ALDH1A1CYP1A2HTTTDP1 | |
| SCHEMBL2695765 | 0.75 | ALDH1A1 (0.50) | CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL2695763 | 0.75 | ALDH1A1 (0.50) | CYP2C19ALDH1A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0982305-B1 | Indane-1-ol derivatives, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2002-03-06 | — | — | EP | disclosed |
| US-6153625-A | Indan-1-ol compounds | ADIR ET COMPAGNIE (FR) | 2000-11-28 | — | — | US | disclosed |
| EP-0982305-A1 | Indane-1-ol derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 2000-03-01 | — | — | EP | disclosed |