Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 5/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 5/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | WNT1 | P04628 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3459364 | 0.78 | HSD17B1 (0.54) | HSD17B1HSD17B2CYP3A4CYP2C9LOXL2 | |
| SCHEMBL146522 | 0.77 | KDR (0.52) | LOXL2KDRAOC3HTR7 | |
| SCHEMBL12947929 | 0.76 | MAP4K4 (0.50) | HSD17B1HSD17B2CYP3A4CYP2C9LOXL2 | |
| SCHEMBL2403212 | 0.76 | HSD17B1 (0.47) | HSD17B1HSD17B2CYP3A4CYP2C9LOXL2 | |
| SCHEMBL21228532 | 0.76 | HSD17B1 (0.68) | HSD17B1HSD17B2CYP3A4CYP2C9 | |
| SCHEMBL2407377 | 0.76 | NPC1 (0.44) | HSD17B1HSD17B2CYP3A4CYP2C9LOXL2 | |
| SCHEMBL1764602 | 0.76 | RAB9A (0.47) | HSD17B1HSD17B2CYP3A4CYP2C9HDAC1 | |
| SCHEMBL29914706 | 0.76 | HSD17B1 (0.68) | HSD17B1HSD17B2CYP3A4CYP2C9 | |
| SCHEMBL3937055 | 0.75 | KMO (0.50) | HSD17B1HSD17B2KDRHDAC1HDAC6 | |
| SCHEMBL5521864 | 0.74 | KDR (0.49) | HSD17B1HSD17B2LOXL2KDRAOC3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116925077-A | Pyrido ring compound, and preparation method, intermediate, composition and application thereof | 一又生物(上海)有限公司 | 2023-10-24 | — | — | CN | disclosed |