Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | STAT1 | P42224 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8489395 | 0.92 | ALDH1A1 (0.59) | NQO1KDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL27412780 | 0.90 | NQO1 (0.54) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL8073969 | 0.90 | NQO1 (0.62) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL8087605 | 0.87 | NQO1 (0.69) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL8485055 | 0.86 | NQO1 (0.58) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL7620708 | 0.86 | NQO1 (0.58) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL6272795 | 0.86 | ALDH1A1 (0.53) | NQO1KDM4EALDH1A1MAPTRAB9A | |
| SCHEMBL6270804 | 0.85 | KDM4E (0.52) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL8488842 | 0.85 | ALDH1A1 (0.60) | NQO1KDM4EALDH1A1MAPTNPC1 | |
| SCHEMBL6275947 | 0.85 | AKR1C3 (0.60) | KDM4EALDH1A1MAPTNPC1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5981495-A | TREATING HEART DISEASE BY ADMINISTERING TO THE HEART PATIENT A BENOPYRAN DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1999-11-09 | — | — | US | disclosed |
| EP-0796854-A1 | Benzopyran derivative and use of said benzopyran derivative for treating heart disease | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1997-09-24 | — | — | EP | disclosed |