Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11045277 | 0.82 | MEN1 (0.56) | KMT2ACHRNA7GAA | |
| Inositol Niacinate SCHEMBL29499769 | 0.82 | ALDH1A1 (0.65) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| Inositol Niacinate SCHEMBL13557040 | 0.82 | ALDH1A1 (0.65) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| Inositol Niacinate SCHEMBL122590 | 0.82 | ALDH1A1 (0.65) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| Inositol Niacinate SCHEMBL122591 | 0.82 | ALDH1A1 (0.65) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| SCHEMBL1843768 | 0.80 | ALDH1A1 (0.46) | ALDH1A1KMT2ALMNACHRNB2CHRNB4 | |
| SCHEMBL285309 | 0.76 | ALDH1A1 (0.57) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| SCHEMBL13580045 | 0.76 | ALDH1A1 (0.57) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| SCHEMBL1866703 | 0.76 | ALDH1A1 (0.57) | ALDH1A1KMT2ALMNAL3MBTL1GAA | |
| SCHEMBL14535107 | 0.76 | ALDH1A1 (0.57) | ALDH1A1KMT2ALMNAL3MBTL1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4451473-A | 3,7-Diazabicyclo [3.3.1] nonanes having anti-arrhythmic activity | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1984-05-29 | — | — | US | disclosed |