Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 4/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.31 |
| ▸ | FEN1 | P39748 | 3/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | DUT | P33316 | 1/20 | 0.30 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | IGF1R | P08069 | 1/20 | 0.30 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | FLT4 | P35916 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | FLT3 | P36888 | 1/20 | 0.30 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.30 |
| ▸ | TEK | Q02763 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29854726 | 0.84 | FGFR1 (0.35) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL13521539 | 0.84 | DGAT1 (0.35) | DGAT1BRD4CREBBPNPC1MAPT | |
| SCHEMBL29514152 | 0.84 | DGAT1 (0.40) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL101528 | 0.84 | DGAT1 (0.40) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL2884544 | 0.84 | DGAT1 (0.35) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL352030 | 0.84 | FGFR1 (0.35) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL31710459 | 0.84 | DGAT1 (0.35) | DGAT1NPC1MAPTDUTEGFR | |
| SCHEMBL31710439 | 0.83 | DGAT1 (0.35) | DGAT1F2RL1NPC1MAPT | |
| SCHEMBL21632481 | 0.82 | DGAT1 (0.36) | DGAT1NPC1MAPT | |
| SCHEMBL21632543 | 0.82 | MAPT (0.35) | DGAT1NPC1MAPTEGFRIGF1R |
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-115215861-B | Aromatic heterocycle substituted alkyne compound and preparation method and application thereof | 上海翊石医药科技有限公司 | 2024-03-15 | — | — | CN | disclosed |
| CN-115215861-A | Aromatic heterocycle substituted alkyne compound and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-10-21 | — | — | CN | disclosed |