Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4664487 | 0.83 | LMNA (0.68) | KEAP1LMNASMN1; SMN2CA12CA9 | |
| SCHEMBL29540801 | 0.80 | KEAP1 (0.70) | KEAP1LMNASMN1; SMN2CA12CA9 | |
| SCHEMBL22233994 | 0.77 | KMT2A (0.57) | LMNASMN1; SMN2CYP19A1KDM4EMEN1 | |
| SCHEMBL22233855 | 0.74 | CYP19A1 (0.65) | KEAP1CA9CA1CA2CYP19A1 | |
| SCHEMBL22234244 | 0.73 | GBA1 (0.57) | KEAP1LMNASMN1; SMN2CYP19A1KDM4E | |
| SCHEMBL6799664 | 0.73 | CYP19A1 (0.59) | LMNASMN1; SMN2CA9CA1CA2 | |
| SCHEMBL4661660 | 0.72 | MEN1 (0.81) | KEAP1LMNASMN1; SMN2CA12CA9 | |
| SCHEMBL4663044 | 0.72 | KEAP1 (0.76) | KEAP1LMNASMN1; SMN2CA12CA9 | |
| SCHEMBL4662993 | 0.72 | POLB (0.70) | KEAP1LMNASMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL10782659 | 0.72 | KEAP1 (0.59) | KEAP1LMNASMN1; SMN2CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |