Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL27680478 | 0.97 | ALDH1A1 (0.67) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| Acetonitrile SCHEMBL4869057 | 0.97 | ALDH1A1 (0.67) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| Water SCHEMBL28050202 | 0.87 | ALDH1A1 (0.83) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| Water SCHEMBL28116489 | 0.87 | ALDH1A1 (0.83) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| Water SCHEMBL27934865 | 0.87 | ALDH1A1 (0.83) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| Water SCHEMBL15657908 | 0.83 | ALDH1A1 (0.77) | ALDH1A1TSHRHSD17B10TDP1LMNA | |
| SCHEMBL4450040 | 0.83 | — | — | |
| Water SCHEMBL18836927 | 0.83 | — | — | |
| Water SCHEMBL8957849 | 0.83 | — | — | |
| SCHEMBL41630 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104535503-A | Method for preparing and using detection agent for measuring content of cobalt in water body | UNIV TONGJI | 2015-04-22 | — | — | CN | disclosed |