Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | SELE | P16581 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 8/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22099993 | 0.85 | MAPT (0.37) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL19583352 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL16369793 | 0.83 | IRAK4 (0.47) | ALDH1A1ICAM1SELEMKNK1MKNK2 | |
| SCHEMBL20764507 | 0.75 | STAT3 (0.45) | ALDH1A1KDM4EGAAMAPTHSD17B10 | |
| SCHEMBL16369610 | 0.74 | EP300 (0.63) | HDAC1HDAC8HDAC6EP300 | |
| SCHEMBL16392500 | 0.74 | EP300 (0.52) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL19608101 | 0.72 | ALDH1A1 (0.51) | ALDH1A1KDM4EGAAMAPTALOX15 | |
| SCHEMBL3544037 | 0.70 | ALDH1A1 (0.49) | ALDH1A1KDM4EMAPTALOX15HSD17B10 | |
| SCHEMBL12260753 | 0.68 | MMP2 (0.60) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL14452820 | 0.68 | EP300 (0.56) | ALDH1A1MAPTHPGDTSHRMKNK1 |
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-2019038405-A1 | NOVEL CYSTOBACTAMIDE DERIVATIVES | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2019-02-28 | — | — | WO | disclosed |