Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GALR3 | O60755 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4425592 | 0.87 | LOXL2 (0.45) | ALDH1A1SMN1; SMN2NPC1RAB9ASIGMAR1 | |
| SCHEMBL9617576 | 0.85 | LMNA (0.42) | ALDH1A1SMN1; SMN2SIGMAR1LMNAHTT | |
| SCHEMBL17788507 | 0.75 | HRH4 (0.50) | SMN1; SMN2SIGMAR1LMNAHTTL3MBTL1 | |
| Cyclohexanone SCHEMBL11249341 | 0.75 | ADRB2 (0.35) | ALDH1A1SMN1; SMN2SIGMAR1LMNAHTT | |
| SCHEMBL21659149 | 0.73 | LOXL2 (0.42) | ALDH1A1SMN1; SMN2NPC1RAB9ASIGMAR1 | |
| SCHEMBL22456025 | 0.71 | SIGMAR1 (0.49) | ALDH1A1SMN1; SMN2NPC1RAB9ASIGMAR1 | |
| Propane SCHEMBL28251881 | 0.71 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL3356678 | 0.71 | SIGMAR1 (0.45) | ALDH1A1SMN1; SMN2SIGMAR1LMNAHTT | |
| SCHEMBL14867 | 0.71 | — | — | |
| SCHEMBL28222778 | 0.71 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2NPC1RAB9ALMNA |
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-4188391-A | 4-[4-(Substituted)piperidino]quinazoline cardiac stimulants | PFIZER INC. (US) | 1980-02-12 | — | — | US | disclosed |