Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | PKLR | P30613 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | CCR6 | P51684 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7469891 | 0.88 | HTR2A (0.48) | PKMALDH1A1CYP2D6CYP2C19HTT | |
| SCHEMBL7475133 | 0.87 | ALDH1A1 (0.50) | PKMSMN1; SMN2MAPTCCR6ALDH1A1 | |
| SCHEMBL8060759 | 0.72 | PKM (0.64) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL23178943 | 0.72 | PKM (0.75) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL31315853 | 0.72 | PKM (1.00) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL1722721 | 0.72 | PKM (1.00) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL7471529 | 0.71 | PKM (0.73) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL28079047 | 0.71 | PKM (0.63) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL7465164 | 0.70 | SMN1; SMN2 (0.55) | PKMSMN1; SMN2MAPTNPC1PKLR | |
| SCHEMBL7468301 | 0.70 | CXCR4 (0.53) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1229025-A1 | NOVEL QUINAZOLINE DERIVATIVES | Japan Energy Corporation (JP) | 2002-08-07 | — | — | EP | disclosed |