Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.31 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.30 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.30 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8912967 | 0.86 | TSHR (0.40) | TSHRPPARDTP53TDP1CA2 | |
| SCHEMBL28509328 | 0.79 | TSHR (0.42) | TSHRPPARDTP53TDP1CA2 | |
| SCHEMBL12876222 | 0.73 | TSHR (0.40) | TSHRPPARDTP53TDP1CA2 | |
| SCHEMBL2356791 | 0.70 | TSHR (0.48) | TSHRPPARDTP53TDP1CA2 | |
| SCHEMBL17737221 | 0.69 | — | — | |
| SCHEMBL4399686 | 0.69 | — | — | |
| SCHEMBL93840 | 0.69 | — | — | |
| SCHEMBL2991333 | 0.69 | — | — | |
| SCHEMBL8346052 | 0.69 | — | — | |
| SCHEMBL17626450 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5635495-A | ANTIARTHRITIC AGENTS TREATING BONE DISORDER, OSTEOPOROSIS; CALCIUM CHANNEL BLOCKERS | THE UPJOHN COMPANY (US) | 1997-06-03 | — | — | US | disclosed |
| EP-0650360-A1 | PHOSPHONO DERIVATIVES AS ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS | THE UPJOHN COMPANY (US) | 1995-05-03 | — | — | EP | disclosed |
| WO-1994002152-A2 | PHOSPHONO DERIVATIVES AS ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS | THE UPJOHN COMPANY (US) | 1994-02-03 | — | — | WO | disclosed |