Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 3/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18290244 | 0.80 | TRPV1 (0.33) | LMNACYP1A2TRPA1CHRM1SLC6A2 | |
| SCHEMBL18290201 | 0.75 | THRA (0.51) | CYP1A2TRPV1THRATHRBGAA | |
| SCHEMBL18290221 | 0.75 | THRA (0.38) | CYP1A2TRPV1THRATHRBGAA | |
| SCHEMBL27832368 | 0.74 | THRA (0.39) | LMNACYP1A2CYP2D6MAPK1TRPA1 | |
| SCHEMBL18290231 | 0.71 | CASR (0.32) | CYP1A2TRPV1THRATHRBGAA | |
| SCHEMBL2964707 | 0.64 | CYP1A2 (0.48) | LMNACYP1A2CYP2D6TRPA1CHRM1 | |
| SCHEMBL28299901 | 0.62 | ALDH1A1 (0.35) | LMNACYP1A2CYP2D6MAPK1TRPA1 | |
| SCHEMBL10022399 | 0.60 | GRIN2D (0.49) | LMNACYP1A2CYP2D6TRPA1CHRM1 | |
| SCHEMBL24925225 | 0.59 | LMNA (0.42) | LMNACYP1A2CYP2D6TRPA1CHRM1 | |
| SCHEMBL6661835 | 0.58 | HPGD (0.41) | LMNACYP1A2MAPK1CNR1CNR2 |
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 |