Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 10/20 | 0.80 |
| ▸ | THRB | P10828 | 10/20 | 0.80 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.61 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.56 |
| ▸ | RARB | P10826 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7934415 | 0.92 | THRA (0.77) | THRATHRBHSD17B3HAO1 | |
| SCHEMBL11490234 | 0.92 | THRA (0.77) | THRATHRBHSD17B3HAO1 | |
| SCHEMBL11440891 | 0.90 | THRA (0.79) | THRATHRBHSD17B3HAO1RARB | |
| SCHEMBL15190601 | 0.89 | THRA (1.00) | THRATHRBHAO1RARB | |
| SCHEMBL10551406 | 0.87 | THRA (0.97) | THRATHRBHAO1RARB | |
| SCHEMBL28908404 | 0.87 | THRA (0.79) | THRATHRBHSD17B3HAO1RARB | |
| SCHEMBL8479392 | 0.87 | HSD17B3 (0.69) | THRATHRBHSD17B3HAO1 | |
| SCHEMBL9138023 | 0.86 | THRA (0.72) | THRATHRBHSD17B3HAO1RARB | |
| SCHEMBL7758945 | 0.85 | HSD17B3 (0.67) | THRATHRBHSD17B3 | |
| SCHEMBL31366289 | 0.85 | HSD17B3 (0.67) | THRATHRBHSD17B3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110938003-B | Preparation method of fingolimod hydrochloride | 新发药业有限公司 | 2022-11-22 | — | — | CN | disclosed |