Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.39 |
| ▸ | EGFR | P00533 | 4/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL20031911 | 0.95 | MAOB (0.41) | THRATHRBMAOBEGFR | |
| SCHEMBL22702989 | 0.92 | THRA (0.47) | THRATHRBMAOBEGFRPTPN11 | |
| SCHEMBL20031909 | 0.90 | MAOB (0.43) | MAOBEGFR | |
| SCHEMBL20031873 | 0.90 | MAOB (0.38) | MAOBEGFR | |
| SCHEMBL20031890 | 0.90 | MAOB (0.38) | MAOBEGFRALDH1A1MEN1KMT2A | |
| SCHEMBL20031650 | 0.90 | MAOB (0.38) | THRATHRBMAOBEGFR | |
| SCHEMBL22683257 | 0.89 | MAOB (0.39) | MAOBEGFRALDH1A1L3MBTL1MEN1 | |
| SCHEMBL22703070 | 0.87 | THRA (0.35) | THRATHRBMAOBEGFR | |
| SCHEMBL22683261 | 0.85 | MEN1 (0.46) | THRATHRBMAOBEGFRPTPN11 | |
| SCHEMBL22683269 | 0.84 | BRD4 (0.52) | MAOBEGFRMAPTKDM4E |
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 |