Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.43 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.39 |
| ▸ | TUBB | P07437 | 2/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28325906 | 0.88 | AKR1B1 (0.52) | ERN1TNKS2METAKR1B1ALOX5 | |
| SCHEMBL9191718 | 0.86 | CA1 (0.46) | ERN1ALOX5PTGS2GAAMAPT | |
| SCHEMBL9620471 | 0.84 | SHBG (0.52) | TNKS2EGFRAKR1B1TNKSALOX5 | |
| SCHEMBL16362239 | 0.82 | AKR1B1 (0.61) | TNKS2METEGFRAKR1B1TNKS | |
| SCHEMBL12121960 | 0.82 | PTGS2 (0.55) | TNKS2EGFRAKR1B1TNKSALOX5 | |
| SCHEMBL12510599 | 0.82 | TNKS2 (0.49) | ERN1TNKS2EGFRAKR1B1TNKS | |
| SCHEMBL14601465 | 0.81 | EGFR (0.41) | TNKS2METEGFRAKR1B1TNKS | |
| SCHEMBL27873502 | 0.81 | TAAR1 (0.44) | TNKS2EGFRAKR1B1TNKSALOX5 | |
| SCHEMBL16854091 | 0.80 | SHBG (0.52) | ERN1PTGS2MAPTALDH1A1PTGS1 | |
| SCHEMBL14262143 | 0.79 | TNKS2 (0.47) | ERN1TNKS2METEGFRAKR1B1 |
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-112079697-A | Preparation method of 5-methyl vanillin | 上海应用技术大学 | 2020-12-15 | — | — | CN | disclosed |