Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8912172 | 0.86 | TSHR (0.40) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL2356791 | 0.85 | TSHR (0.48) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL12212115 | 0.80 | TSHR (0.41) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL10394481 | 0.77 | TSHR (0.40) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL10395233 | 0.77 | TSHR (0.40) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL15981078 | 0.76 | TSHR (0.39) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL10395235 | 0.76 | CA12 (0.42) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL10395211 | 0.76 | CA12 (0.42) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL2491743 | 0.75 | TSHR (0.48) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL12731355 | 0.73 | TSHR (0.46) | TSHRCA12CA1CA2CA9 |
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-5635495-A | ANTIARTHRITIC AGENTS TREATING BONE DISORDER, OSTEOPOROSIS; CALCIUM CHANNEL BLOCKERS | THE UPJOHN COMPANY (US) | 1997-06-03 | — | — | US | disclosed |