Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | ADH1B | P00325 | 2/20 | 0.39 |
| ▸ | ADH1C | P00326 | 2/20 | 0.39 |
| ▸ | ADH1A | P07327 | 2/20 | 0.39 |
| ▸ | ADH7 | P40394 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 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 | |
|---|---|---|---|---|
| SCHEMBL27197660 | 0.79 | ADH1B (0.33) | TSHRALDH1A1CA1ADH1BADH1A | |
| SCHEMBL269108 | 0.78 | — | — | |
| SCHEMBL1536124 | 0.75 | TSHR (0.41) | TSHRALDH1A1CA1CA2ADH1B | |
| SCHEMBL4542993 | 0.75 | — | — | |
| SCHEMBL28012333 | 0.75 | TSHR (0.41) | TSHRALDH1A1CA1CA2ADH1B | |
| SCHEMBL19582726 | 0.75 | TSHR (0.41) | TSHRALDH1A1CA1CA2ADH1B | |
| SCHEMBL1995724 | 0.75 | — | — | |
| Iodide SCHEMBL11778186 | 0.75 | TSHR (0.48) | TSHRALDH1A1CA1CA2ADH1B | |
| SCHEMBL6357143 | 0.75 | TSHR (0.48) | TSHRALDH1A1CA1CA2ADH1B | |
| Hydrochloric Acid SCHEMBL10874495 | 0.75 | TSHR (0.36) | TSHRALDH1A1CA1CA2ADH1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012032513-A1 | BORANOPHOSPHATE DERIVATIVES FOR THE TREATMENT OF OSTEOARTHRITIS | BAR-ILAN UNIVERSITY (IL) | 2012-03-15 | — | — | WO | disclosed |