Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6814772 | 1.00 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1 | |
| Tetrahydrofuran SCHEMBL2361115 | 0.97 | ALDH1A1 (0.50) | ALDH1A1KDM4ETDP1 | |
| Tetrahydrofuran SCHEMBL5235661 | 0.94 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL8859291 | 0.92 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL11713823 | 0.92 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL28246276 | 0.90 | ALDH1A1 (0.38) | ALDH1A1KDM4E | |
| Tetrahydrofuran SCHEMBL310535 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TDP1 | |
| Tetrahydrofuran SCHEMBL2336993 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TDP1 | |
| Tetrahydrofuran SCHEMBL28609324 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TDP1 | |
| Dioxane SCHEMBL2949971 | 0.84 | TTR (0.43) | TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6355620-B1 | ANTIBIOTIC ERYTHROMYCIN DERIVATIVES | ABBOTT LABORATORIES | 2002-03-12 | — | — | US | disclosed |