Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL3447266 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL31026479 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL929237 | 0.78 | APP (0.52) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL31026495 | 0.76 | KMT2A (0.41) | ALDH1A1HSD17B10HPGDCYP1A2NPC1 | |
| SCHEMBL3448582 | 0.76 | ASIC3 (0.44) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL29429053 | 0.74 | APP (0.55) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL28782824 | 0.74 | CYP1A2 (0.55) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL28649524 | 0.73 | MAPT (0.59) | ALDH1A1CYP3A4HSD17B10HPGDCYP1A2 | |
| SCHEMBL28549450 | 0.73 | HPGD (0.48) | ALDH1A1HPGDNPC1RAB9AMAPT | |
| SCHEMBL28548217 | 0.73 | APP (0.42) | ALDH1A1CYP3A4HPGDCYP1A2CYP2C9 |
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-114671816-B | Preparation method of axial chiral aryl triazole compound | 浙江大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-114671816-A | Preparation method of axial chiral aryl triazole compound | 浙江大学 | 2022-06-28 | — | — | CN | disclosed |