Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24638090 | 0.80 | — | — | |
| SCHEMBL1360717 | 0.75 | — | — | |
| SCHEMBL21263304 | 0.69 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL16743101 | 0.67 | ALDH1A1 (0.34) | ALDH1A1TSHR | |
| SCHEMBL13711248 | 0.65 | ALDH1A1 (0.67) | ALDH1A1TSHRMAPK1 | |
| SCHEMBL12262230 | 0.65 | ACACB (0.32) | — | |
| SCHEMBL20039823 | 0.65 | CHRM2 (0.31) | — | |
| SCHEMBL18790149 | 0.63 | — | — | |
| SCHEMBL8987534 | 0.62 | ALDH1A1 (0.60) | ALDH1A1TSHR | |
| SCHEMBL24638098 | 0.62 | — | — |
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-2013126683-A1 | REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS | NALCO COMPANY (US) | 2013-08-29 | — | — | WO | disclosed |