Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 6/20 | 0.53 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.53 |
| ▸ | CYP27A1 | Q02318 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | HTR2B | P41595 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | METAP1 | P53582 | 2/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL972021 | 1.00 | CYP24A1 (0.53) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL8435265 | 0.90 | ALDH1A1 (0.56) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL9235535 | 0.90 | MAPT (0.52) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL9233137 | 0.88 | MAPT (0.50) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL19128297 | 0.88 | CYP24A1 (0.51) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL4730776 | 0.87 | ALDH1A1 (0.70) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL8921371 | 0.87 | CYP24A1 (0.54) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL14548463 | 0.87 | THRA (0.55) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL9233039 | 0.87 | THRA (0.50) | CYP24A1CYP26A1CYP27A1ALDH1A1KDM4E | |
| SCHEMBL8050780 | 0.85 | MEN1 (0.55) | CYP24A1CYP26A1ALDH1A1KDM4EMEN1 |
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-6359138-B1 | CENTRAL NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. | 2002-03-19 | — | — | US | disclosed |
| EP-0846683-B1 | 4-Hydroxy-piperidine derivatives | HOFFMANN LA ROCHE (CH) | 2001-09-19 | — | — | EP | disclosed |
| EP-0846683-A1 | 4-Hydroxy-piperidine derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1998-06-10 | — | — | EP | disclosed |