Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 2/20 | 0.31 |
| ▸ | PPARA | Q07869 | 2/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL18290244 | 0.77 | TRPV1 (0.33) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL18290201 | 0.73 | THRA (0.51) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL18290221 | 0.72 | THRA (0.38) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL18290202 | 0.71 | LMNA (0.33) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL27832368 | 0.69 | THRA (0.39) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL28294546 | 0.65 | CYP1A2 (0.38) | GAAMAPTCYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL2964707 | 0.63 | CYP1A2 (0.48) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL6400171 | 0.61 | GABRA1 (0.54) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL10022399 | 0.59 | GRIN2D (0.49) | TRPV1GAAMAPTNPSR1CYP1A2 | |
| SCHEMBL12868248 | 0.59 | ATM (0.37) | MAPTALDH1A1HTTHSD17B10 |
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 |