Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATG4B | Q9Y4P1 | 5/20 | 0.65 |
| ▸ | NPC1 | O15118 | 8/20 | 0.61 |
| ▸ | RAB9A | P51151 | 8/20 | 0.61 |
| ▸ | MEN1 | O00255 | 7/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.61 |
| ▸ | LMNA | P02545 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | PKM | P14618 | 3/20 | 0.56 |
| ▸ | STAT3 | P40763 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.52 |
| ▸ | CDK2 | P24941 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.52 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.52 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3234242 | 0.80 | ATG4B (0.67) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL1896161 | 0.80 | NPC1 (0.61) | ATG4BNPC1RAB9AMEN1KMT2A | |
| Nithiamide SCHEMBL158858 | 0.80 | NPC1 (0.63) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL18529298 | 0.79 | LMNA (0.67) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL18529254 | 0.79 | ATG4B (1.00) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL3234255 | 0.77 | ATG4B (0.68) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL18424530 | 0.76 | ATG4B (0.69) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL881339 | 0.76 | LMNA (0.84) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL12599400 | 0.76 | NPC1 (0.59) | ATG4BNPC1RAB9AMEN1KMT2A | |
| SCHEMBL3466003 | 0.76 | LMNA (0.67) | ATG4BNPC1RAB9AMEN1KMT2A |
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-2632460-B1 | THIOPHENE DERIVATIVES FOR USE IN THE TREATMENT OF TUBERCULOSIS | UNIV VIRGINIA PATENT FOUNDATION (US) | 2018-02-28 | — | — | EP | disclosed |