Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 2/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL44759 | 0.89 | — | — | |
| Biphenyl SCHEMBL27965239 | 0.84 | LMNA (0.52) | LMNAALDH1A1MAPTTDP1BLM | |
| Dichloroacetic Acid SCHEMBL28158662 | 0.77 | LMNA (0.83) | LMNAALDH1A1MAPTTDP1TSHR | |
| Benzene SCHEMBL27899474 | 0.74 | LMNA (0.53) | LMNAALDH1A1MAPTMEN1KMT2A | |
| Dichloroacetic Acid SCHEMBL21724799 | 0.74 | LMNA (0.77) | LMNAACHEALDH1A1MAPTTDP1 | |
| Dichloroacetic Acid SCHEMBL27886822 | 0.74 | LMNA (0.77) | LMNAACHEALDH1A1MAPTTDP1 | |
| Benzene SCHEMBL27691898 | 0.72 | ACHE (0.50) | LMNAACHEALDH1A1MAPTTDP1 | |
| Chloroform SCHEMBL28940869 | 0.72 | — | — | |
| Isobutyramide SCHEMBL29027438 | 0.71 | ACHE (0.40) | LMNAACHEMAPTTDP1BLM | |
| Piperazine SCHEMBL11438673 | 0.71 | MAPT (0.35) | LMNAMAPTTSHRPMP22KMT2A |
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-105859692-B | Thioether compound containing pyrimidine, thiadiazole ring and amide structure and application thereof | 浙江工业大学 | 2018-02-27 | — | — | CN | disclosed |
| CN-105859692-A | Thioether compound containing pyrimidine, thiadiazole ring and amide structure and application thereof | 浙江工业大学 | 2016-08-17 | — | — | CN | disclosed |