Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | AGXT | P21549 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28210657 | 0.87 | TDP1 (0.47) | ALOX5PTGS1PTGS2CA2L3MBTL1 | |
| SCHEMBL9866229 | 0.87 | NR4A1 (0.50) | ALOX5 | |
| SCHEMBL27908333 | 0.83 | ALDH1A1 (0.42) | TSHRALDH1A1CA9AOC3L3MBTL1 | |
| SCHEMBL1573556 | 0.83 | TSHR (0.40) | TSHRALDH1A1IDO1CCNB2CDK1 | |
| SCHEMBL1415749 | 0.83 | TSHR (0.40) | TSHRALDH1A1IDO1CCNB2CDK1 | |
| SCHEMBL9563424 | 0.83 | TSHR (0.40) | TSHRALDH1A1IDO1CCNB2CDK1 | |
| SCHEMBL8592588 | 0.83 | ALDH1A1 (0.40) | TSHRALDH1A1IDO1CCNB2CDK1 | |
| SCHEMBL4009083 | 0.82 | PTPN1 (0.36) | TSHRALDH1A1MAOB | |
| Hydrochloric Acid SCHEMBL28524418 | 0.81 | AGXT (0.44) | TSHRALDH1A1IDO1CCNB2CDK1 | |
| SCHEMBL6949217 | 0.81 | TAAR1 (0.42) | TSHRIDO1ALOX5AOC3 |
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-5585373-A | STABILITY, LOWER TOXICITY | TAIHO PHARMACEUTICAL CO., LTD (JP) | 1996-12-17 | — | — | US | disclosed |