Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5567954 | 0.80 | POLB (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL5133301 | 0.72 | HSD17B1 (0.40) | SMN1; SMN2ALDH1A1NPC1RAB9AHSD17B1 | |
| SCHEMBL15904634 | 0.69 | LMNA (0.44) | SMN1; SMN2ALDH1A1MEN1KMT2AHSD17B1 | |
| SCHEMBL17716402 | 0.66 | SCN9A (0.36) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL1614004 | 0.64 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL29829411 | 0.64 | POLB (0.49) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL1421329 | 0.62 | GABRA5 (0.40) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL15110981 | 0.61 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL4911470 | 0.61 | KMT2A (0.39) | SMN1; SMN2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL17716400 | 0.60 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1NPC1RAB9AMEN1 |
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-1605946-B1 | THIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES | VERTEX PHARMA (US) | 2008-05-28 | — | — | EP | disclosed |