Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CD44 | P16070 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAT | P00750 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.40 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28446637 | 0.98 | ALDH1A1 (0.45) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| SCHEMBL29357959 | 0.84 | — | — | |
| SCHEMBL4867594 | 0.84 | ALDH1A1 (0.65) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| SCHEMBL33788 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL6570703 | 0.82 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| Bromide SCHEMBL4899892 | 0.82 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| Sulfuric Acid SCHEMBL28280181 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| Trimethylammonium SCHEMBL27901505 | 0.78 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDHSD17B10MMP2 | |
| SCHEMBL27863672 | 0.78 | ALOX15 (0.50) | ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL11576672 | 0.76 | CD44 (0.41) | ALDH1A1KDM4EHPGDHSD17B10CD44 |
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-107652425-B | Zinc complex catalyst for synthesizing polycyclohexene carbonate | 河南理工大学 | 2020-08-28 | — | — | CN | claimed |
| CN-107652425-B | Zinc complex catalyst for synthesizing polycyclohexene carbonate | 河南理工大学 | 2020-08-28 | — | — | CN | disclosed |