Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28263637 | 0.74 | MTNR1A (0.46) | — | |
| SCHEMBL9774796 | 0.74 | TP53 (0.36) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL2107806 | 0.72 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL2107809 | 0.72 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL14465627 | 0.71 | GPBAR1 (0.38) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL25059065 | 0.71 | MTNR1A (0.35) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL21207860 | 0.71 | MTNR1A (0.35) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL5291180 | 0.69 | ALDH1A1 (0.42) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL12285479 | 0.69 | ALDH1A1 (0.42) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL12329328 | 0.69 | OPRM1 (0.33) | ALDH1A1SMN1; 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-104684907-A | Antidiabetic tricyclic compounds | MERCK SHARP & DOHME | 2015-06-03 | — | — | CN | disclosed |