Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 10/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.58 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.58 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | VCP | P55072 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21708025 | 0.85 | CCR4 (0.76) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL5486145 | 0.85 | CCR4 (1.00) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL21708002 | 0.82 | CCR4 (0.71) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL4561810 | 0.80 | CCR4 (0.68) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL28297353 | 0.80 | CCR4 (0.68) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL12603585 | 0.77 | CCR4 (0.64) | CCR4SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL21708018 | 0.76 | CCR4 (1.00) | CCR4SMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL2173513 | 0.76 | CCR4 (0.58) | CCR4SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL2173118 | 0.76 | CCR4 (0.62) | CCR4SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL262399 | 0.76 | CCR4 (0.62) | CCR4SMN1; SMN2TAS1R3TAS1R1TAS1R2 |
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-106699752-B | Application of the 5- piperonyl -2- pridylamino thiazole as anticancer drug | 湖南大学 | 2019-05-14 | — | — | CN | disclosed |