Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.44 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.43 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.43 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20031667 | 0.83 | ESR1 (0.53) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL299840 | 0.79 | HSPA1A (0.56) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL14117964 | 0.73 | ALDH1A1 (0.59) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL3297858 | 0.73 | ALDH1A1 (0.59) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL29726032 | 0.71 | ALDH1A1 (0.60) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL7597251 | 0.71 | ALDH1A1 (0.60) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL1127945 | 0.71 | ALDH1A1 (0.60) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL5793779 | 0.71 | KMT2A (0.55) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL7602121 | 0.71 | ALDH1A1 (0.60) | HSPA1APABPC1USP2KMT2AMAPT | |
| SCHEMBL12914365 | 0.70 | KDM4E (0.68) | HSPA1APABPC1USP2KMT2AMAPT |
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-2018063105-A1 | [5]HELICENE DERIVATIVES AS MOLECULAR REPORTERS FOR DIAGNOSTIC APPLICATIONS AND METHODS OF SYNTHESIS THEREFOR | NATIONAL SCIENCE AND TECHNOLOGY DEVELOPMENT AGENCY (TH) | 2018-04-05 | — | — | WO | disclosed |