Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5223298 | 0.89 | — | — | |
| SCHEMBL1292950 | 0.75 | — | — | |
| SCHEMBL7278528 | 0.73 | NOS2 (0.41) | ADORA2BADORA1NOS3NOS2GAA | |
| SCHEMBL1293068 | 0.72 | BCHE (0.39) | ADORA2BADORA1 | |
| SCHEMBL2513639 | 0.72 | HPGD (0.36) | SMYD3HPGDNAMPTNOS3NOS2 | |
| SCHEMBL16255821 | 0.71 | — | — | |
| SCHEMBL11009719 | 0.70 | ADORA2A (0.31) | ADORA2B | |
| SCHEMBL7272832 | 0.70 | NOS2 (0.44) | ADORA2BADORA1NOS2 | |
| SCHEMBL3410538 | 0.69 | SMYD3 (0.54) | SMYD3HPGDNAMPTALDH1A1 | |
| SCHEMBL587459 | 0.69 | — | — |
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-115141200-B | Methylbenzylidene tetrahydropyrazol [3,4-D ] pyridine [1,2-A ] pyrimidinone compound B and application thereof | 中国科学院新疆理化技术研究所 | 2023-10-13 | — | — | CN | disclosed |