Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.35 |
| ▸ | HTR7 | P34969 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL7076070 | 0.84 | HTR7 (0.40) | HTR1AHTR7ALDH1A1GPR84HPGD | |
| SCHEMBL5608737 | 0.83 | DNMT1 (0.38) | HTR1AHTR7ALDH1A1HIF1AHSD17B10 | |
| SCHEMBL9350829 | 0.82 | DNMT1 (0.39) | HTR1AHTR7ALDH1A1TSHRHSD17B10 | |
| SCHEMBL27988564 | 0.79 | HTR1A (0.39) | HTR1AHTR7ALDH1A1HPGDTSHR | |
| SCHEMBL5608644 | 0.79 | HTR7 (0.37) | HTR1AHTR7ALDH1A1SLC6A3EPHX1 | |
| SCHEMBL28223174 | 0.78 | DNMT1 (0.35) | HTR1AHTR7ALDH1A1GABRA1GABRG2 | |
| SCHEMBL160594 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TSHRHIF1AHSD17B10DNMT1 | |
| SCHEMBL1453442 | 0.75 | TRPM4 (0.37) | ALDH1A1HPGDTSHRMAPK1CASP1 | |
| SCHEMBL30391805 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TSHRHIF1AHSD17B10DNMT1 | |
| SCHEMBL13786719 | 0.75 | EPHX1 (0.38) | ALDH1A1HPGDHIF1AHSD17B10L3MBTL1 |
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-2005028467-A1 | ANTIBACTERIAL 3,5-DIAMINOPIPERIDINE-SUBSTITUTE AROMATIC AND HETEROAROMATIC COMPOUNDS | ANADYS PHARMACEUTICALS, INC. (US) | 2005-03-31 | — | — | WO | disclosed |