Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 4/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL11045332 | 0.85 | TSHR (0.42) | TSHREGLN1CA12CA1CA2 | |
| SCHEMBL11047025 | 0.83 | TSHR (0.54) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL11024772 | 0.81 | TSHR (0.52) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL11022194 | 0.81 | EGLN1 (0.52) | TSHREGLN1CA12CA1CA2 | |
| SCHEMBL11024760 | 0.81 | EGLN1 (0.52) | EGLN1CA12CA1CA2CA9 | |
| SCHEMBL31454007 | 0.74 | TSHR (0.56) | TSHRPPARDGAAMAPTALDH1A1 | |
| SCHEMBL5961215 | 0.71 | TSHR (1.00) | TSHRPPARDGAATDP1 | |
| SCHEMBL26483 | 0.71 | TSHR (1.00) | TSHRPPARDGAATDP1 | |
| Acetic Acid SCHEMBL28974626 | 0.69 | TSHR (0.75) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL12495312 | 0.69 | EGLN1 (0.65) | EGLN1GAASMN1; SMN2MAPTHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0063411-B1 | SUBSTITUTED METHANEPHOSHONIC ACID DERIVATIVES, THEIR USE AS HERBICIDES, HERBICIDAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR PREPARING THEM | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-06-05 | — | — | EP | disclosed |
| US-4454073-A | HERBICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-06-12 | — | — | US | disclosed |
| EP-0063411-A1 | Substituted methanephoshonic acid derivatives, their use as herbicides, herbicidal compositions containing them, and processes for preparing them | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1982-10-27 | — | — | EP | disclosed |