Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25826359 | 0.90 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL7010397 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL7010385 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL21171730 | 0.71 | TSHR (0.31) | ALDH1A1TSHRHSD17B10 | |
| SCHEMBL17643537 | 0.71 | — | — | |
| SCHEMBL15121006 | 0.70 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL27663198 | 0.70 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL19906429 | 0.69 | TDP1 (0.50) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL11101890 | 0.69 | — | — | |
| SCHEMBL11772255 | 0.69 | — | — |
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-20200087703-A1 | METABOLIC LABELING OF BACTERIAL TEICHOIC ACIDS CELL WALL | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2020-03-19 | — | — | US | disclosed |