Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ERN1 | O75460 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7092074 | 0.80 | SMN1; SMN2 (0.61) | SMN1; SMN2ERN1ALDH1A1HPGDHTT | |
| SCHEMBL7400011 | 0.77 | MAPT (0.50) | SMN1; SMN2ERN1ALDH1A1HPGDMAPT | |
| SCHEMBL28064700 | 0.77 | PTGS2 (0.44) | SMN1; SMN2ERN1PTGDR2ALDH1A1HPGD | |
| SCHEMBL19328399 | 0.76 | ALDH1A1 (0.42) | SMN1; SMN2PTGDR2ALDH1A1HPGDHTT | |
| SCHEMBL8161041 | 0.76 | PTGER1 (0.48) | SMN1; SMN2ERN1PTGDR2ALDH1A1HPGD | |
| SCHEMBL9825309 | 0.75 | GCK (0.39) | SMN1; SMN2PTGDR2ALDH1A1HPGDHTT | |
| SCHEMBL28549312 | 0.75 | BRD4 (0.47) | SMN1; SMN2ERN1PTGDR2ALDH1A1HPGD | |
| SCHEMBL9119355 | 0.75 | KDM4E (0.52) | SMN1; SMN2ERN1PTGDR2ALDH1A1HPGD | |
| SCHEMBL720372 | 0.73 | CA12 (0.50) | ALDH1A1MEN1KMT2A | |
| SCHEMBL5627486 | 0.73 | CYP19A1 (0.48) | SMN1; SMN2ERN1ALDH1A1HPGDHTT |
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-0167371-B1 | DIHYDROPYRIDINE COMPOUNDS, THEIR PRODUCTION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1991-03-06 | — | — | EP | disclosed |
| US-4727082-A | CARDIOVASCULAR DISORDERS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1988-02-23 | — | — | US | disclosed |
| EP-0167371-A2 | Dihydropyridine compounds, their production, and pharmaceutical compositions containing them | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1986-01-08 | — | — | EP | disclosed |