Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9463612 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL10267375 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL13176815 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL106930 | 0.95 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL13773120 | 0.95 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL13573065 | 0.95 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL13773133 | 0.95 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRHSD17B10TDP1 | |
| SCHEMBL17208249 | 0.88 | ALDH1A1 (0.36) | ALDH1A1LMNA | |
| SCHEMBL14556003 | 0.88 | ALDH1A1 (0.36) | ALDH1A1LMNA | |
| SCHEMBL14555940 | 0.88 | ALDH1A1 (0.36) | ALDH1A1LMNA |
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-2012054521-A2 | ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS | NOVABAY PHARMACEUTICLAS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |