Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.67 |
| ▸ | TAS1R3 | Q7RTX0 | 16/20 | 0.65 |
| ▸ | TAS1R2 | Q8TE23 | 15/20 | 0.65 |
| ▸ | TAS1R1 | Q7RTX1 | 15/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9691775 | 1.00 | MLYCD (0.67) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL517994 | 0.91 | MLYCD (0.77) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL775118 | 0.88 | SSTR3 (0.61) | ALDH1A1 | |
| SCHEMBL12858459 | 0.87 | TAS1R3 (0.63) | TAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL517895 | 0.87 | MLYCD (0.71) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL8174817 | 0.85 | MLYCD (0.50) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL13927734 | 0.85 | TAS1R3 (0.72) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL13927736 | 0.85 | TAS1R3 (0.72) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL4175029 | 0.85 | TAS1R3 (0.72) | MLYCDTAS1R3TAS1R2TAS1R1ALDH1A1 | |
| SCHEMBL2453198 | 0.84 | TAS1R3 (0.81) | MLYCDTAS1R3TAS1R2TAS1R1 |
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-2019027054-A1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2019-02-07 | — | — | WO | disclosed |