Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3013121 | 0.86 | LMNA (0.55) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL1245063 | 0.86 | LMNA (0.55) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL18262815 | 0.81 | LMNA (0.53) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| Alcohol SCHEMBL9765954 | 0.80 | ALOX15 (0.51) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL8975143 | 0.80 | LMNA (0.49) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL18262905 | 0.80 | LMNA (0.49) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL14981162 | 0.78 | LMNA (0.50) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL18262891 | 0.78 | LMNA (0.50) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL18802752 | 0.77 | CYP3A4 (0.43) | LMNATRPA1CHRM1SLC6A2ADRA1A | |
| SCHEMBL214157 | 0.77 | LMNA (0.68) | LMNATRPA1CHRM1SLC6A2ADRA1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107398290-A | catalyst for synthesizing thymol | 江苏理工学院 | 2017-11-28 | — | — | CN | disclosed |
| CN-107382670-A | Preparation method of thymol | 江苏理工学院 | 2017-11-24 | — | — | CN | disclosed |
| CN-104744219-B | Preparation method of thymol | 江苏理工学院 | 2017-07-11 | — | — | CN | disclosed |