Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | APBA1 | Q02410 | 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 | |
|---|---|---|---|---|
| SCHEMBL1076980 | 0.98 | TSHR (0.39) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL15456626 | 0.79 | TSHR (0.41) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL939773 | 0.73 | ALDH1A1 (0.47) | TSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL3394048 | 0.73 | ALDH1A1 (0.51) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL5713252 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL612325 | 0.72 | ALDH1A1 (0.50) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL11371842 | 0.71 | TSHR (0.40) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL173835 | 0.71 | — | — | |
| SCHEMBL7825503 | 0.70 | ALDH1A1 (0.38) | TSHRTDP1EPHX2ALDH1A1GAA | |
| SCHEMBL594992 | 0.70 | TSHR (0.46) | TSHRGAA |
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-2012020271-A1 | PROCESS FOR THE PREPARATION OF MONTELUKAST SODIUM | RICHTER GEDEON NYRT. (HU) | 2012-02-16 | — | — | WO | claimed |