Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 5/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Acetophenone SCHEMBL27577933 | 0.95 | ALDH1A1 (0.62) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28513709 | 0.90 | TSHR (0.56) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28515793 | 0.89 | LMNA (0.57) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28262080 | 0.89 | LMNA (0.57) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28262081 | 0.89 | LMNA (0.57) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Hexyl Acetate SCHEMBL30625874 | 0.89 | TSHR (0.59) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28186100 | 0.86 | CES2 (0.60) | ALDH1A1LMNAHPGDCES2CES1 | |
| Acetic Acid Pentyl Ester SCHEMBL3179656 | 0.85 | TSHR (0.57) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Acetophenone SCHEMBL28519002 | 0.85 | LMNA (0.56) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| Benzoic Acid SCHEMBL2470729 | 0.85 | ALDH1A1 (0.62) | TSHRTP53CYP3A4MAPK1ALDH1A1 |
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-105801608-A | Novel rare earth europium complex and preparation method thereof | 阜阳师范学院 | 2016-07-27 | — | — | CN | disclosed |