Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL14556268 | 1.00 | TSHR (0.31) | TSHRCA1CA2 | |
| SCHEMBL14209777 | 0.89 | — | — | |
| SCHEMBL15369672 | 0.82 | CA1 (0.39) | CA1CA2 | |
| SCHEMBL30377725 | 0.82 | CA1 (0.32) | CA1CA2 | |
| SCHEMBL10012427 | 0.82 | TSHR (0.36) | TSHR | |
| SCHEMBL14320784 | 0.81 | — | — | |
| SCHEMBL14321562 | 0.81 | — | — | |
| SCHEMBL14320919 | 0.81 | — | — | |
| SCHEMBL14237209 | 0.81 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL838763 | 0.81 | CA1 (0.31) | CA1CA2 |
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-116655449-A | (R) - (+) -1,2, 4-butanetriol and efficient synthesis method and application thereof | 青岛海药科技有限公司 | 2023-08-29 | — | — | CN | disclosed |