Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 4/20 | 0.42 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL369200 | 0.78 | ADH5 (0.55) | ADH5ACMSDALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL368427 | 0.77 | ADH5 (0.40) | ADH5ACMSDALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL10147484 | 0.72 | ERCC1 (0.32) | ALDH1A1 | |
| SCHEMBL11980189 | 0.67 | ADH5 (0.58) | ADH5ACMSDALDH1A1POLB | |
| SCHEMBL876884 | 0.67 | ADH5 (0.59) | ADH5ALDH1A1POLB | |
| SCHEMBL1516314 | 0.67 | ADH5 (0.59) | ADH5ALDH1A1POLB | |
| SCHEMBL877384 | 0.67 | ADH5 (0.59) | ADH5ALDH1A1POLB | |
| SCHEMBL367611 | 0.66 | ACMSD (0.43) | ACMSDALDH1A1POLB | |
| SCHEMBL367695 | 0.65 | ADH5 (0.42) | ADH5ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL12836446 | 0.60 | ADH5 (0.41) | ADH5ACMSDALDH1A1POLB |
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-2012009227-A1 | NOVEL DIHYDROPYRIDIN-2(1H)-ONE COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS AND NEUROKININ-3 RECEPTOR ANTAGONISTS | N30 PHARMACEUTICALS, LLC (US) | 2012-01-19 | — | — | WO | disclosed |