Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | PTPN7 | P35236 | 3/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Carbon Monoxide SCHEMBL9812739 | 0.93 | PTPN7 (0.38) | TSHRHMGCREPHX1ALDH1A1CES2 | |
| SCHEMBL11059990 | 0.89 | — | — | |
| SCHEMBL1553812 | 0.72 | — | — | |
| SCHEMBL11608357 | 0.67 | — | — | |
| SCHEMBL28705208 | 0.64 | — | — | |
| Carbon Monoxide SCHEMBL4163928 | 0.63 | TSHR (0.78) | TSHRHMGCRALDH1A1 | |
| Carbon Monoxide SCHEMBL4165395 | 0.63 | TSHR (0.78) | TSHRHMGCRALDH1A1 | |
| SCHEMBL3456364 | 0.63 | — | — | |
| SCHEMBL5167349 | 0.63 | — | — | |
| Carbon Monoxide SCHEMBL4149340 | 0.63 | TSHR (0.78) | TSHRHMGCRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0146348-B1 | SUBSTITUTED NAPHTHALENES, INDOLES, BENZOFURANS AND BENZOTHIOPHENES AS LIPOXYGENASE INHIBITORS | THE UPJOHN COMPANY (US) | 1991-07-31 | — | — | EP | disclosed |
| EP-0146348-A2 | Substituted naphthalenes, indoles, benzofurans and benzothiophenes as lipoxygenase inhibitors | THE UPJOHN COMPANY (US) | 1985-06-26 | — | — | EP | disclosed |