Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11024657 | 0.85 | TSHR (0.50) | TSHREGLN1CA12CA1CA2 | |
| SCHEMBL11023916 | 0.84 | EGLN1 (0.37) | TSHREGLN1CA12CA1CA2 | |
| SCHEMBL11024772 | 0.74 | TSHR (0.52) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL2150701 | 0.73 | TSHR (0.65) | TSHRTDP1PPARD | |
| SCHEMBL11047025 | 0.72 | TSHR (0.54) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL2028174 | 0.69 | TSHR (0.46) | TSHRTDP1PPARDNPC1POLB | |
| Butane SCHEMBL11045330 | 0.69 | TSHR (0.36) | TSHREGLN1MAPT | |
| SCHEMBL21626325 | 0.68 | TSHR (0.38) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL30956298 | 0.68 | TSHR (0.38) | TSHRTDP1PPARDNPC1POLB | |
| SCHEMBL1723694 | 0.68 | MAPT (0.42) | TSHREGLN1MAPTRAB9ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |