Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.53 |
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | DHODH | Q02127 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10788485 | 0.86 | CYP1A2 (0.61) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL28472490 | 0.83 | RAB9A (0.56) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL28476423 | 0.83 | RAB9A (0.53) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL4582098 | 0.80 | RAB9A (0.83) | RAB9ANPC1DHODHPKMMEN1 | |
| SCHEMBL28475782 | 0.80 | F2 (0.69) | RAB9ANPC1PKMMEN1KMT2A | |
| SCHEMBL14809359 | 0.75 | TSHR (0.54) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL11304291 | 0.75 | NPC1 (0.62) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL28624148 | 0.73 | MEN1 (0.54) | RAB9ANPC1PKMCYP1A2MEN1 | |
| SCHEMBL5780823 | 0.73 | F2 (0.50) | RAB9ANPC1PKMCYP1A2HSD17B10 | |
| SCHEMBL4021933 | 0.71 | NPC1 (0.59) | RAB9ANPC1PKMCYP1A2HSD17B10 |
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-118223050-A | Electrochemical synthesis method of triazole compound | 上海合全药业股份有限公司 | 2024-06-21 | — | — | CN | disclosed |
| CN-110318065-B | Method for electrochemically synthesizing 1,2, 4-triazole compound | 浙江工业大学 | 2020-10-09 | — | — | CN | disclosed |