Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | EPRS1 | P07814 | 1/20 | 0.35 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.35 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | GALR3 | O60755 | 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 | |
|---|---|---|---|---|
| SCHEMBL29451092 | 0.80 | EPRS1 (0.51) | KDM1ACES2DGAT1EPRS1GRIK1 | |
| SCHEMBL257339 | 0.80 | EPRS1 (0.51) | KDM1ACES2DGAT1EPRS1GRIK1 | |
| SCHEMBL25532291 | 0.78 | CES2 (0.47) | KDM1ACES2DGAT1EPRS1NOTUM | |
| SCHEMBL29333933 | 0.77 | CES2 (0.46) | KDM1ACES2DGAT1EPRS1NOTUM | |
| SCHEMBL7787369 | 0.77 | CES2 (0.46) | KDM1ACES2DGAT1EPRS1NOTUM | |
| SCHEMBL23967959 | 0.77 | KDM1A (0.40) | KDM1ACES2DGAT1EPRS1NPFFR1 | |
| SCHEMBL6888239 | 0.77 | KDM1A (0.44) | KDM1ACES2DGAT1EPRS1NPFFR1 | |
| SCHEMBL3143470 | 0.77 | CES2 (0.46) | KDM1ACES2DGAT1EPRS1NOTUM | |
| SCHEMBL1330833 | 0.77 | DGAT1 (0.59) | KDM1ACES2DGAT1EPRS1NPFFR1 | |
| SCHEMBL516822 | 0.77 | NOTUM (0.54) | CES2NOTUMPDK2GAA |
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-109880065-A | Conjugated polymer containing trifluoromethyl and the preparation method and application thereof | 中国科学院化学研究所 | 2019-06-14 | — | — | CN | disclosed |