Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Thiodiglycol SCHEMBL10659331 | 0.82 | TDP1 (0.53) | TDP1ROCK2TSHR | |
| SCHEMBL11309790 | 0.80 | ROCK2 (0.45) | TDP1ROCK2 | |
| SCHEMBL26702543 | 0.76 | ROCK2 (0.47) | TDP1ROCK2 | |
| Thiodiglycol SCHEMBL11578815 | 0.76 | TDP1 (0.59) | TDP1ROCK2TSHR | |
| SCHEMBL11538329 | 0.74 | EPHX1 (0.39) | TDP1ROCK2TSHR | |
| SCHEMBL7004897 | 0.74 | — | — | |
| SCHEMBL7002778 | 0.74 | — | — | |
| SCHEMBL30779147 | 0.72 | — | — | |
| SCHEMBL7952242 | 0.72 | ROCK2 (0.38) | TDP1ROCK2TSHR | |
| Thiodiglycol SCHEMBL10534858 | 0.71 | TDP1 (1.00) | TDP1ROCK2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-2240054-A | — | — | None | — | — | JP | disclosed |
| JP-H02240054-A | NOVEL DITHIOL COMPOUND | TORAY IND INC | 1990-09-25 | — | — | JP | disclosed |