Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 10/20 | 0.54 |
| ▸ | TTR | P02766 | 3/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | CDC25A | P30304 | 1/20 | 0.38 |
| ▸ | CDC25C | P30307 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23203617 | 0.90 | AHR (0.62) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL20031833 | 0.88 | MAPT (0.39) | AHRALDH1A1LMNAKMT2A | |
| SCHEMBL21659053 | 0.85 | AHR (0.61) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL23204096 | 0.85 | AHR (0.61) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL29706029 | 0.82 | AHR (0.63) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL20208693 | 0.82 | AHR (0.63) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL20208783 | 0.81 | AHR (0.60) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL29706073 | 0.81 | AHR (0.60) | AHRTTRMCL1CDC25ACDC25C | |
| SCHEMBL21019291 | 0.79 | AHR (0.81) | AHRTTRCA1CA2ALDH1A1 | |
| SCHEMBL24662745 | 0.79 | AHR (0.48) | AHRTTRALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3518746-B1 | [5]HELICENE DERIVATIVES AS MOLECULAR REPORTERS FOR DIAGNOSTIC APPLICATIONS AND METHODS OF SYNTHESIS THEREFOR | NATIONAL SCIENCE AND TECH DEVELOPMENT AGENCY (TH) | 2020-11-25 | — | — | EP | disclosed |