Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 7/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MME | P08473 | 1/20 | 0.32 |
| ▸ | ECE1 | P42892 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL28592261 | 0.78 | MAPT (0.49) | NR1H2NR1I2ALDH1A1ALOX15 | |
| Bicarbonate SCHEMBL28536229 | 0.77 | HTT (0.46) | GRM5PTGDR2HSD17B2MMEECE1 | |
| SCHEMBL13597755 | 0.75 | GRM5 (0.42) | GRM5PTGDR2HSD17B2MMEECE1 | |
| SCHEMBL28599366 | 0.74 | NR1H2 (0.49) | NR1H2NR1I2KCNN4 | |
| SCHEMBL29006701 | 0.74 | NR1H2 (0.41) | NR1H2GRM5NR1I2KCNN4 | |
| SCHEMBL30416064 | 0.74 | NR1H2 (0.41) | NR1H2GRM5NR1I2KCNN4 | |
| SCHEMBL28596673 | 0.73 | NR1H2 (0.51) | NR1H2NR1I2ALDH1A1 | |
| SCHEMBL28592339 | 0.72 | NR1H2 (0.46) | NR1H2NR1I2ALDH1A1 | |
| SCHEMBL19745708 | 0.71 | NR1H2 (0.40) | NR1H2NR1I2ALDH1A1 | |
| SCHEMBL29006699 | 0.71 | NR1H2 (0.42) | NR1H2NR1I2ALDH1A1ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113149868-B | Method for synthesizing axichiral diene compound by trivalent rhodium catalysis | 陕西师范大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-113149868-A | Method for synthesizing axial chiral allene compound by using trivalent rhodium as catalyst | 陕西师范大学 | 2021-07-23 | — | — | CN | disclosed |