Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5597331 | 0.88 | TSHR (0.52) | TSHRCA1CA2CA9CYP2D6 | |
| SCHEMBL7759867 | 0.81 | TSHR (0.74) | TSHRCA1CA2CA9CYP2C9 | |
| Thiobenzoic Acid SCHEMBL7714480 | 0.81 | TSHR (0.50) | TSHRCA1CA2CA9CYP2D6 | |
| SCHEMBL28883194 | 0.81 | TSHR (0.54) | TSHRCA1CA2CA9SCN1A | |
| Benzyl Alcohol SCHEMBL5488535 | 0.78 | TSHR (0.69) | TSHRCA1CA2CA9CYP2C9 | |
| SCHEMBL28867831 | 0.76 | TSHR (0.42) | TSHRCA1CA2CA9KEAP1 | |
| SCHEMBL11150868 | 0.76 | TSHR (0.52) | TSHRLTA4HKEAP1BCL2BCL2L1 | |
| SCHEMBL8561232 | 0.75 | TSHR (0.55) | TSHRCA1CA2CYP2D6CYP2C19 | |
| Thiobenzoic Acid SCHEMBL2049606 | 0.75 | TSHR (0.44) | TSHRCA1CA2CA9KEAP1 | |
| SCHEMBL11517264 | 0.73 | TSHR (0.49) | TSHRCA1CA2CA9CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5739228-A | Polymerization using thionoester compounds as chain transfer agents | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) | 1998-04-14 | — | — | US | disclosed |