Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 2/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | MC3R | P41968 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4860930 | 0.83 | GABRA5 (0.44) | MAPKAPK2NAPRTPRKCIATRGABRP | |
| SCHEMBL28133648 | 0.81 | MAPKAPK2 (0.35) | MAPKAPK2HTTNAPRTPRKCIATR | |
| SCHEMBL23374468 | 0.77 | HTT (0.34) | HTTF2CA2ADORA3TSHR | |
| SCHEMBL22583527 | 0.74 | NQO1 (0.36) | MAPKAPK2NAPRTPRKCIMKNK1MKNK2 | |
| SCHEMBL3938944 | 0.72 | — | — | |
| SCHEMBL29861340 | 0.70 | HTT (0.33) | HTT | |
| SCHEMBL4668812 | 0.69 | L3MBTL1 (0.57) | NAPRTCA2TSHRADRA1AKMT2A | |
| SCHEMBL27612752 | 0.69 | KDM4E (0.44) | HTTNAPRTCA2 | |
| SCHEMBL4333718 | 0.69 | — | — | |
| SCHEMBL31439135 | 0.68 | PARP1 (0.51) | HTTNAPRTTSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114907276-B | Alpha-substituted amino-pyrazineacetamide derivative, and preparation method and application thereof | 山东大学 | 2024-01-26 | — | — | CN | disclosed |
| CN-114907276-B | Alpha-substituted amino-pyrazineacetamide derivative, and preparation method and application thereof | 山东大学 | 2024-01-26 | — | — | CN | disclosed |
| CN-114907276-B | Alpha-substituted amino-pyrazineacetamide derivative, and preparation method and application thereof | 山东大学 | 2024-01-26 | — | — | CN | disclosed |