Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8373339 | 0.88 | ALDH1A1 (0.46) | ALDH1A1TSHR | |
| SCHEMBL245112 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRGAA | |
| SCHEMBL19347083 | 0.78 | — | — | |
| SCHEMBL8374682 | 0.74 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL444933 | 0.74 | — | — | |
| SCHEMBL10486528 | 0.73 | ALDH1A1 (0.44) | ALDH1A1TSHR | |
| SCHEMBL8374684 | 0.73 | ALDH1A1 (0.62) | ALDH1A1TSHR | |
| SCHEMBL6386790 | 0.72 | — | — | |
| SCHEMBL7707637 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7707644 | 0.72 | NAALAD2 (0.45) | ALDH1A1TSHR |
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-1999060187-A1 | METAL SURFACE TREATMENT AGENTS, METHODS OF TREATING METAL SURFACES AND PRE-COATED STEEL SHEETS | DACRAL S.A. (FR) | 1999-11-25 | — | — | WO | disclosed |