Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL295285 | 0.95 | TSHR (0.55) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| SCHEMBL22995734 | 0.95 | TSHR (0.55) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| Acrylic Acid Methyl Ester SCHEMBL28001520 | 0.90 | TSHR (0.49) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| Methacrylic Acid SCHEMBL28196914 | 0.88 | TSHR (0.47) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| Acrylic Acid SCHEMBL28237259 | 0.83 | HCAR2 (0.40) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| SCHEMBL3169558 | 0.80 | THRB (0.53) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| SCHEMBL5070208 | 0.80 | THRB (0.54) | TSHRTHRBCYP2C19HCAR2TRPA1 | |
| SCHEMBL27522725 | 0.80 | TSHR (0.51) | TSHRTHRBCYP2C19CYP1A2CYP2D6 | |
| SCHEMBL17460170 | 0.79 | CYP2D6 (0.61) | TSHRTHRBCYP2C19HCAR2CYP1A2 | |
| SCHEMBL1171628 | 0.79 | SMN1; SMN2 (0.46) | TSHRCYP1A2CYP2D6PKMSMN1; SMN2 |
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-108473484-A | Compounds useful as TRPM8 modulators | 赛诺米克斯公司 | 2018-08-31 | — | — | CN | disclosed |