Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 15/20 | 0.52 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29831651 | 1.00 | MAP4K4 (0.52) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL22163940 | 0.85 | MAP4K4 (0.49) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL28431475 | 0.83 | MAP4K4 (0.49) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL20392686 | 0.83 | ADORA2A (0.59) | MAP4K4LMNAUSP2TP53CYP1A2 | |
| SCHEMBL30738319 | 0.83 | ADORA2A (0.59) | MAP4K4LMNAUSP2TP53CYP1A2 | |
| SCHEMBL29831558 | 0.83 | MAP4K4 (0.49) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL28436900 | 0.82 | MAP4K4 (0.49) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL29831762 | 0.82 | MAP4K4 (0.49) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL22180298 | 0.82 | MAP4K4 (0.51) | MAP4K4TGFBR1LMNAUSP2TP53 | |
| SCHEMBL30738227 | 0.82 | MAP4K4 (0.51) | MAP4K4TGFBR1LMNAUSP2TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111377906-B | Substituted pyrazine compounds, their preparation and use | 四川科伦博泰生物医药股份有限公司 | 2022-09-02 | — | — | CN | disclosed |
| CN-111377906-A | Substituted pyrazine compounds, their preparation and use | 四川科伦博泰生物医药股份有限公司 | 2020-07-07 | — | — | CN | disclosed |