Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 9/20 | 0.51 |
| ▸ | THRB | P10828 | 9/20 | 0.51 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27832368 | 0.88 | THRA (0.39) | THRATHRBTRPV1PKMNPSR1 | |
| SCHEMBL18290221 | 0.84 | THRA (0.38) | THRATHRBTRPV1PKMNPSR1 | |
| SCHEMBL18290244 | 0.76 | TRPV1 (0.33) | THRATHRBTRPV1PKMNPSR1 | |
| SCHEMBL28299901 | 0.76 | ALDH1A1 (0.35) | THRATHRBPKMNPSR1GAA | |
| SCHEMBL18290202 | 0.75 | LMNA (0.33) | THRATHRBTRPV1NPSR1GAA | |
| SCHEMBL18290231 | 0.73 | CASR (0.32) | THRATHRBTRPV1NPSR1GAA | |
| SCHEMBL18290236 | 0.72 | ALDH1A1 (0.35) | THRATHRBPKMNPSR1CYP1A2 | |
| Thymol SCHEMBL248717 | 0.69 | TRPA1 (0.66) | THRATHRBNPSR1GAAKDM4E | |
| SCHEMBL2492586 | 0.68 | THRA (0.72) | THRATHRBHSP90AA1 | |
| SCHEMBL2964707 | 0.67 | CYP1A2 (0.48) | THRBTRPV1PKMNPSR1GAA |
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-2016192631-A1 | ABIETANE-TYPE DITERPENE COMPOUND HAVING LIPID-LOWERING ACTIVITY, METHOD FOR PREPARING SAME, AND USE OF SAME | 中国科学院上海药物研究所 | 2016-12-08 | — | — | WO | disclosed |