Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.67 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | ERN1 | O75460 | 4/20 | 0.51 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | CTSA | P10619 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23249824 | 1.00 | HSD17B1 (0.67) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL23249859 | 0.82 | FTO (0.51) | HSD17B1HSD17B2PTGES2HDAC4HDAC8 | |
| SCHEMBL5673332 | 0.81 | HSD17B1 (0.97) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL23249814 | 0.81 | CNR1 (0.50) | HSD17B1HSD17B2HDAC4HDAC8HDAC2 | |
| SCHEMBL23249811 | 0.80 | HSD17B1 (0.42) | HSD17B1HSD17B2ERN1MKNK1MKNK2 | |
| SCHEMBL29890188 | 0.80 | HSD17B1 (0.42) | HSD17B1HSD17B2ERN1MKNK1MKNK2 | |
| SCHEMBL29890034 | 0.78 | HSD17B1 (0.41) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL23249818 | 0.78 | HSD17B1 (0.41) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29890158 | 0.77 | FPR2 (0.50) | PTGES2HDAC4HDAC8HDAC2PDGFRB | |
| SCHEMBL23249841 | 0.77 | FPR2 (0.50) | PTGES2HDAC4HDAC8HDAC2PDGFRB |
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-4045025-A1 | TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS | Ambys Medicines, Inc. (US) | 2022-08-24 | — | — | EP | disclosed |