Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | NAMPT | P43490 | 4/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | BRAF | P15056 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12978017 | 0.87 | ALDH1A1 (0.68) | ALDH1A1LMNAHIF1ANPC1RAB9A | |
| SCHEMBL11083219 | 0.86 | NT5E (0.60) | ALDH1A1LMNANPC1RAB9AHTT | |
| SCHEMBL11078859 | 0.84 | HDAC1 (0.59) | LMNANPC1RAB9AHTTMAPT | |
| SCHEMBL30533390 | 0.84 | LMNA (0.81) | ALDH1A1LMNAHIF1ANPC1NAMPT | |
| SCHEMBL11073535 | 0.82 | TSHR (0.60) | ALDH1A1LMNAHIF1ANPC1RAB9A | |
| SCHEMBL13701744 | 0.82 | ALDH1A1 (0.64) | ALDH1A1LMNAHIF1ANPC1RAB9A | |
| SCHEMBL11081421 | 0.81 | NPSR1 (0.53) | ALDH1A1KMT2A | |
| SCHEMBL12017613 | 0.80 | BRAF (0.79) | ALDH1A1LMNAHIF1ANPC1RAB9A | |
| SCHEMBL16881794 | 0.80 | NPC1 (0.75) | ALDH1A1LMNAHIF1ANPC1RAB9A | |
| SCHEMBL11078900 | 0.79 | NPC1 (0.60) | ALDH1A1LMNAHIF1ANPC1RAB9A |
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-0119428-A2 | Biscarboxamides for treating diseases, and process for their preparation | BAYER AG (DE) | 1984-09-26 | — | — | EP | disclosed |