Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16442943 | 0.78 | — | — | |
| SCHEMBL8852489 | 0.76 | TSHR (0.54) | TSHRALDH1A1CA2CA9 | |
| SCHEMBL23732 | 0.76 | — | — | |
| Propene SCHEMBL7590306 | 0.72 | — | — | |
| SCHEMBL23116592 | 0.71 | — | — | |
| SCHEMBL22711591 | 0.71 | — | — | |
| Hydrogen Sulfide SCHEMBL11571948 | 0.71 | TSHR (0.50) | TSHRALDH1A1CA2CA9 | |
| Hydrogen Sulfide SCHEMBL21352279 | 0.71 | TSHR (0.50) | TSHRALDH1A1CA2CA9 | |
| Phosphine SCHEMBL20503111 | 0.71 | — | — | |
| SCHEMBL8523341 | 0.71 | — | — |
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-2019216645-A1 | MODIFIED CONJUGATED DIENE-BASED POLYMER AND RUBBER COMPOSITION COMPRISING SAME | 주식회사 엘지화학 (KR) | 2019-11-14 | — | — | WO | disclosed |