Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 6/20 | 0.35 |
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CA4 | P22748 | 6/20 | 0.35 |
| ▸ | CA9 | Q16790 | 6/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29092245 | 0.80 | NOTUM (0.45) | NPC1RAB9AALDH1A1KMT2ALMNA | |
| SCHEMBL29092634 | 0.80 | ALDH1A1 (0.43) | NPC1RAB9AALDH1A1TSHRCA1 | |
| SCHEMBL29092087 | 0.79 | SMN1; SMN2 (0.44) | NPC1RAB9AALDH1A1TSHRKMT2A | |
| SCHEMBL30584646 | 0.78 | MGLL (0.40) | ALDH1A1CA1CA2CA9KMT2A | |
| SCHEMBL29092100 | 0.78 | MGLL (0.40) | ALDH1A1CA1CA2CA9KMT2A | |
| SCHEMBL29092054 | 0.77 | SMN1; SMN2 (0.42) | NPC1RAB9AALDH1A1KMT2ALMNA | |
| SCHEMBL29092553 | 0.76 | IDO1 (0.46) | ALDH1A1CYP2A6MAPT | |
| SCHEMBL29092094 | 0.76 | MAPT (0.48) | RAB9AALDH1A1CA9GAAMAPT | |
| SCHEMBL29092092 | 0.76 | ALDH1A1 (0.44) | RAB9AALDH1A1TSHRLMNASMN1; SMN2 | |
| SCHEMBL29092063 | 0.69 | KCNN4 (0.38) | NPC1RAB9AALDH1A1MGLLSLC5A1 |
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-116751172-A | Synthesis method of diiodinated 1,2, 3-triazole compound | 海南师范大学 | 2023-09-15 | — | — | CN | disclosed |