Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 7/20 | 0.52 |
| ▸ | DRD2 | P14416 | 6/20 | 0.52 |
| ▸ | HRH1 | P35367 | 4/20 | 0.51 |
| ▸ | HRH2 | P25021 | 2/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | HTR2B | P41595 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | TEK | Q02763 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7289453 | 0.95 | TDP1 (0.64) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL10366021 | 0.88 | TDP1 (0.58) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL10365630 | 0.85 | TDP1 (0.50) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL7279249 | 0.84 | ACHE (0.54) | TDP1HRH1MEN1KMT2A | |
| SCHEMBL10365243 | 0.84 | HRH1 (0.58) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL9091641 | 0.83 | TDP1 (0.66) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL10365491 | 0.83 | DRD3 (0.51) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL7292650 | 0.82 | ALDH1A1 (0.47) | TDP1ALDH1A1SLC6A4SLC6A3 | |
| SCHEMBL10366905 | 0.77 | SLC6A9 (0.49) | TDP1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL10366024 | 0.77 | SIGMAR1 (0.56) | ALDH1A1DRD3DRD2HRH1HTR2A |
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-0094159-B1 | DIHYDROPYRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1990-03-14 | — | — | EP | disclosed |
| US-4892875-A | HYPOTENSIVE, RENAL VASODILATION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-01-09 | — | — | US | disclosed |
| EP-0094159-A1 | Dihydropyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1983-11-16 | — | — | EP | disclosed |