Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14809988 | 0.86 | CYBB (0.33) | ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL14820737 | 0.77 | ALDH1A1 (0.41) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL7930351 | 0.75 | ALDH1A1 (0.33) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL7088869 | 0.75 | TAAR1 (0.31) | ALDH1A1L3MBTL1TDP1SMN1; SMN2TSHR | |
| SCHEMBL4717661 | 0.75 | DPP4 (0.35) | ALDH1A1MAPTMAPK1KMT2ANPSR1 | |
| SCHEMBL2919461 | 0.73 | MAPT (0.52) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL29406125 | 0.70 | MAPT (0.37) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL29822698 | 0.70 | ALDH1A1 (0.41) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL229536 | 0.70 | ALDH1A1 (0.41) | ALDH1A1MAPTL3MBTL1NSD2EGFR | |
| SCHEMBL238097 | 0.70 | MAPT (0.37) | ALDH1A1MAPTL3MBTL1NSD2EGFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2668165-A1 | NOVEL TETRAHYDROQUINOLINE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-12-04 | — | — | EP | disclosed |
| WO-2012101068-A1 | NOVEL TETRAHYDROQUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-08-02 | — | — | WO | disclosed |