Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11145254 | 0.84 | TSHR (0.71) | TSHRALDH1A1KDM4EPOLBCA1 | |
| Ethylene Glycol SCHEMBL10895397 | 0.84 | TSHR (0.71) | TSHRALDH1A1KDM4EPOLBLTA4H | |
| SCHEMBL1109806 | 0.83 | TSHR (0.52) | TSHRALDH1A1KDM4EPOLBLTA4H | |
| Methacrylic Acid SCHEMBL1088569 | 0.80 | TSHR (0.54) | TSHRALDH1A1KDM4EPOLBTDP1 | |
| SCHEMBL4663055 | 0.80 | L3MBTL1 (0.50) | TSHRALDH1A1EPHX2TDP1HTT | |
| Ethylene Glycol SCHEMBL130292 | 0.80 | TSHR (0.79) | TSHRALDH1A1KDM4EPOLBLTA4H | |
| Ethylene SCHEMBL11162366 | 0.79 | TSHR (0.88) | TSHRALDH1A1KDM4EPOLBCA1 | |
| SCHEMBL793986 | 0.79 | TSHR (0.56) | TSHRALDH1A1KDM4EPOLBCA1 | |
| Propanol SCHEMBL1756185 | 0.78 | TSHR (0.68) | TSHRALDH1A1KDM4EPOLBLTA4H | |
| SCHEMBL6119293 | 0.78 | TSHR (0.50) | TSHRKDM4EPOLBLTA4HEPHX2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0808832-B1 | Fluorinated vitamin D3 analogs | HOFFMANN LA ROCHE (CH) | 2003-04-23 | — | — | EP | disclosed |
| US-5872113-A | COMPOUNDS FOR TREATMENT OF OSTEOPOROSIS AND BONE DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1999-02-16 | — | — | US | disclosed |
| EP-0808832-A2 | Fluorinated vitamin D3 analogs | F. HOFFMANN-LA ROCHE AG (CH) | 1997-11-26 | — | — | EP | disclosed |