Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2548853 | 0.88 | TSHR (0.36) | TSHRALDH1A1CYP3A4NFKB1NPSR1 | |
| SCHEMBL3626423 | 0.81 | — | — | |
| SCHEMBL1147490 | 0.80 | ATM (0.31) | TSHRALDH1A1 | |
| SCHEMBL1147499 | 0.78 | — | — | |
| SCHEMBL3286639 | 0.74 | — | — | |
| SCHEMBL9951290 | 0.74 | ALDH1A1 (0.42) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL26276 | 0.74 | — | — | |
| SCHEMBL11875781 | 0.74 | — | — | |
| SCHEMBL9508813 | 0.74 | — | — | |
| SCHEMBL2549645 | 0.73 | — | — |
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-109321272-A | A kind of preparation method and process units of coal tar production fuel oil | 山东恒导石油化工股份有限公司 | 2019-02-12 | — | — | CN | disclosed |