Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | DGKA | P23743 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12662617 | 0.93 | ALDH1A1 (0.52) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL8744185 | 0.93 | ALDH1A1 (0.52) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL8744187 | 0.93 | ALDH1A1 (0.52) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL30444260 | 0.88 | TSHR (0.55) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL16874352 | 0.86 | TSHR (0.62) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL19260200 | 0.86 | TSHR (0.62) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL22832710 | 0.85 | ADORA3 (0.53) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL22832709 | 0.85 | ADORA3 (0.53) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL873582 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ADORA3NR1I2PGRPTGS2 | |
| SCHEMBL873581 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ADORA3NR1I2PGRPTGS2 |
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-106999973-A | System and method for discharging edible material | 阿甘芳香和精细化工有限公司 | 2017-08-01 | — | — | CN | disclosed |