Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL11663502 | 0.79 | FFAR3 (0.41) | CA2 | |
| SCHEMBL334747 | 0.79 | — | — | |
| Dichloroacetic Acid SCHEMBL11665661 | 0.76 | LMNA (0.48) | ALDH1A1CA2 | |
| Trichloroacetic Acid SCHEMBL29019127 | 0.76 | TSHR (0.71) | ALDH1A1TP53TSHRL3MBTL1 | |
| Bromide SCHEMBL11663685 | 0.76 | — | — | |
| SCHEMBL28419279 | 0.76 | — | — | |
| Methyl Phosphonate SCHEMBL9863002 | 0.76 | CA2 (0.57) | TSHRCA2 | |
| Trichloroacetic Acid SCHEMBL28531155 | 0.73 | TSHR (0.67) | ALDH1A1TP53TSHRL3MBTL1 | |
| Trichloroacetic Acid SCHEMBL5875229 | 0.73 | — | — | |
| Trichloroacetic Acid SCHEMBL6552197 | 0.72 | — | — |
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-4127401-A | Aminomethanephosphonic acid compounds containing plant-growth regulant compositions | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-28 | — | — | US | disclosed |