Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11089455 | 0.89 | ALDH1A1 (0.38) | ALDH1A1MAPTGAAL3MBTL1MEN1 | |
| SCHEMBL11095711 | 0.88 | CYP3A4 (0.40) | ALDH1A1MAPTGAAL3MBTL1LMNA | |
| SCHEMBL11087533 | 0.86 | ALDH1A1 (0.37) | ALDH1A1MAPTGAAL3MBTL1SMN1; SMN2 | |
| SCHEMBL11093127 | 0.78 | MEN1 (0.34) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL11090519 | 0.77 | CYP3A4 (0.34) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL11260058 | 0.77 | KCNA5 (0.43) | ALDH1A1MAPTGAASMN1; SMN2LMNA | |
| SCHEMBL11203944 | 0.74 | ALDH1A1 (0.42) | ALDH1A1GAASMN1; SMN2MEN1KMT2A | |
| SCHEMBL11157410 | 0.72 | GAA (0.43) | ALDH1A1MAPTGAAL3MBTL1SMN1; SMN2 | |
| SCHEMBL11266308 | 0.72 | ALDH1A1 (0.34) | ALDH1A1MAPTGAAL3MBTL1MEN1 | |
| SCHEMBL11625289 | 0.65 | KDM4E (0.43) | ALDH1A1MAPTGAAL3MBTL1SMN1; SMN2 |
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-4486431-A | Cardiotonic use of 4,5-dihydro-6-(4-pyridinyl)-3(2H)-pyridazinones | STERLING DRUG INC. (US) | 1984-12-04 | — | — | US | disclosed |