Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | NTRK3 | Q16288 | 2/20 | 0.36 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19986629 | 0.87 | TSHR (0.44) | MAPTTP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19986683 | 0.84 | KDR (0.38) | KDRBLMROCK2ROCK1MAPT | |
| SCHEMBL19986556 | 0.81 | TSHR (0.48) | MAPTTP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19986684 | 0.78 | SLC6A3 (0.40) | KDRBLMMAPTTP53NPC1 | |
| SCHEMBL19986559 | 0.75 | TSHR (0.46) | MAPTTP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19986681 | 0.69 | TSHR (0.47) | MAPTTP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22094215 | 0.68 | CDK4 (0.42) | ROCK2ROCK1 | |
| SCHEMBL19986682 | 0.68 | TSHR (0.45) | MAPTTP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19986554 | 0.68 | MEN1 (0.47) | KDRBLMMAPTGRM4NAMPT | |
| SCHEMBL22093571 | 0.67 | HTT (0.37) | ROCK2ROCK1MAPTGRM4NAMPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |