Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL10478971 | 0.82 | CES2 (0.39) | ALDH1A1CES2CES1 | |
| SCHEMBL5928017 | 0.77 | ALDH1A1 (0.41) | ALDH1A1CES2CES1 | |
| SCHEMBL5928015 | 0.77 | ALDH1A1 (0.41) | ALDH1A1CES2CES1 | |
| SCHEMBL23239447 | 0.75 | LMNA (0.36) | — | |
| SCHEMBL11394615 | 0.72 | ALDH1A1 (0.38) | ALDH1A1CES2CES1 | |
| SCHEMBL11394611 | 0.72 | ALDH1A1 (0.38) | ALDH1A1CES2CES1 | |
| SCHEMBL11421688 | 0.72 | ALDH1A1 (0.38) | ALDH1A1CES2CES1 | |
| SCHEMBL3815140 | 0.70 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL6355165 | 0.67 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL4113066 | 0.66 | — | — |
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-6706193-B1 | TREATING WITH NONIONIC SURFACTANT, ADSORBING ON ANIONIC EXCHANGE RESIN AND ELUTING; QUANTITATIVE PRECIPITATION USING FLOCCULATING AGENT | 3M INNOVATIVE PROPERTIES COMPANY | 2004-03-16 | — | — | US | disclosed |