Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 4/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5567950 | 0.80 | NLRP3 (0.38) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL5133302 | 0.72 | SMN1; SMN2 (0.36) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 | |
| SCHEMBL13301095 | 0.66 | NLRP3 (0.38) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL22638084 | 0.65 | LMNA (0.48) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 | |
| SCHEMBL1239299 | 0.65 | CYP3A4 (0.45) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 | |
| SCHEMBL24149773 | 0.64 | TGFBR1 (0.39) | LMNAALDH1A1MAPTPOLBNLRP3 | |
| SCHEMBL19718385 | 0.62 | — | — | |
| SCHEMBL12550525 | 0.62 | ALDH1A1 (0.53) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 | |
| SCHEMBL6249193 | 0.61 | HSD17B1 (0.45) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 | |
| SCHEMBL6249195 | 0.61 | HSD17B1 (0.45) | HSD17B1HSD17B2LMNACYP3A4ALDH1A1 |
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 |