Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | FLT1 | P17948 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.42 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.42 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2830984 | 0.88 | ALDH1A1 (0.50) | ALDH1A1MAPK1FAAHCYP3A4HSD17B10 | |
| SCHEMBL2830832 | 0.87 | ALDH1A1 (0.49) | ALDH1A1MAPK1FAAHCYP3A4HSD17B10 | |
| SCHEMBL2828940 | 0.87 | ALDH1A1 (0.49) | ALDH1A1MAPK1FAAHCYP3A4HSD17B10 | |
| SCHEMBL2830000 | 0.86 | NPC1 (0.47) | KMT2ASMN1; SMN2PKMMEN1LMNA | |
| SCHEMBL2827996 | 0.86 | KMT2A (0.47) | ALDH1A1MAPK1KDRFLT1KMT2A | |
| SCHEMBL2829161 | 0.86 | HPGD (0.50) | ALDH1A1MAPK1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL2826937 | 0.86 | ALDH1A1 (0.48) | ALDH1A1MAPK1FAAHCYP3A4HSD17B10 | |
| SCHEMBL2832758 | 0.85 | ALDH1A1 (0.47) | ALDH1A1KMT2ASMN1; SMN2MEN1LMNA | |
| SCHEMBL2831135 | 0.84 | NPC1 (0.51) | ALDH1A1MAPK1FAAHCYP3A4KMT2A | |
| SCHEMBL2827571 | 0.84 | LMNA (0.47) | ALDH1A1MAPK1FAAHCYP3A4HSD17B10 |
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-1844044-B1 | THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-07-21 | — | — | EP | claimed |