Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MET | P08581 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8529682 | 0.94 | AKR1B1 (0.46) | EGFRERBB2AKR1B1APPTNKS2 | |
| SCHEMBL8529307 | 0.89 | PTGS2 (0.50) | MAPTALDH1A1 | |
| SCHEMBL8534375 | 0.77 | MIF (0.47) | KDM4EALDH1A1 | |
| SCHEMBL4542980 | 0.76 | LTA4H (0.50) | ALDH1A1MAOBMAOA | |
| SCHEMBL28489147 | 0.76 | AKR1B1 (0.50) | AKR1B1GAAKDM4EMAPTMET | |
| SCHEMBL9475495 | 0.76 | APP (0.70) | MAPTAPPMAOBMAOA | |
| SCHEMBL10126440 | 0.75 | ABL1 (0.43) | EGFRERBB2GAAKDM4EMAPT | |
| SCHEMBL28403764 | 0.75 | AKR1B1 (0.69) | AKR1B1METALOX5TNKS2 | |
| SCHEMBL3241580 | 0.73 | MEN1 (0.50) | KDM4EMAPTALDH1A1APPMAOB | |
| SCHEMBL6338880 | 0.73 | TUBB4A (0.60) | ALDH1A1APPMAOBMAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-5840991-A | 3,4,5-TRIHYDROXYBENZYL-4-HYDROXYPHENYL THIOETHER | DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) | 1998-11-24 | — | — | US | claimed |
| US-5840991-A | 3,4,5-TRIHYDROXYBENZYL-4-HYDROXYPHENYL THIOETHER | DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) | 1998-11-24 | — | — | US | disclosed |