Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.65 |
| ▸ | CA2 | P00918 | 2/20 | 0.65 |
| ▸ | CA7 | P43166 | 2/20 | 0.65 |
| ▸ | CA9 | Q16790 | 2/20 | 0.65 |
| ▸ | CA12 | O43570 | 1/20 | 0.65 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.65 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | AHR | P35869 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2226770 | 0.97 | — | — | |
| SCHEMBL154527 | 0.97 | — | — | |
| Water SCHEMBL9443323 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| SCHEMBL28525728 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| Water SCHEMBL28888589 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| Iodide SCHEMBL5695908 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| SCHEMBL29069477 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| SCHEMBL4444134 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| Hydrochloric Acid SCHEMBL11293911 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 | |
| Ammonia Solution, Strong SCHEMBL4259791 | 0.94 | CA1 (0.65) | CA1CA2CA7CA9CA12 |
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-1992013820-A1 | PROCESS FOR THE PREPARATION OF ALKYL-4-HALOPHENYL ETHERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-08-20 | — | — | WO | disclosed |