Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.53 |
| ▸ | CTSS | P25774 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 4/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CD38 | P28907 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.40 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2576656 | 1.00 | TAS2R14 (0.53) | TAS2R14CTSSPARP1DHODHHDAC6 | |
| SCHEMBL5490483 | 0.85 | TAS2R14 (0.50) | TAS2R14CTSSPARP1DHODHHDAC6 | |
| SCHEMBL6173688 | 0.85 | PARP1 (0.53) | TAS2R14PARP1LMNAGAACD38 | |
| SCHEMBL28052031 | 0.85 | TAS2R14 (0.55) | TAS2R14CTSSDHODHHDAC6LMNA | |
| SCHEMBL28192127 | 0.84 | TAS2R14 (0.41) | TAS2R14CTSSPARP1DHODHHDAC6 | |
| SCHEMBL7348566 | 0.83 | CA2 (0.43) | PARP1GAAKDM4EALDH1A1MAPT | |
| SCHEMBL5182718 | 0.83 | TAS2R14 (0.40) | TAS2R14CTSSPARP1DHODHHDAC6 | |
| SCHEMBL697951 | 0.83 | TAS2R14 (0.67) | TAS2R14CTSSDHODHHDAC6LMNA | |
| SCHEMBL12327907 | 0.83 | TAS2R14 (0.54) | TAS2R14CTSSDHODHHDAC6LMNA | |
| SCHEMBL29656425 | 0.83 | TAS2R14 (0.54) | TAS2R14CTSSDHODHHDAC6LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3994138-A1 | ESTROGEN-RELATED RECEPTOR ALPHA (ERRalpha) MODULATORS | Lead Pharma Holding B.V. (NL) | 2022-05-11 | — | — | EP | disclosed |