Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 8/20 | 0.54 |
| ▸ | NOD2 | Q9HC29 | 5/20 | 0.54 |
| ▸ | ALDH3A1 | P30838 | 3/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28205246 | 0.82 | NOD1 (0.59) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL28414053 | 0.82 | NOD1 (0.61) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL9622551 | 0.81 | NOD1 (0.52) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL4060858 | 0.78 | NOD1 (0.59) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL29531344 | 0.78 | NOD1 (0.57) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL26632851 | 0.78 | NOD1 (0.57) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL30285319 | 0.78 | NOD1 (0.61) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL27929447 | 0.78 | NOD1 (0.57) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL28145979 | 0.78 | NOD1 (0.57) | NOD1NOD2ALDH3A1ALOX5GAA | |
| SCHEMBL3902283 | 0.78 | ALDH3A1 (0.58) | NOD1NOD2ALDH3A1ALOX5GAA |
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-111285792-B | 2-substituted indole compound and preparation method thereof | 三峡大学 | 2023-05-02 | — | — | CN | disclosed |
| CN-111285792-A | 2-substituted indole compound and preparation method thereof | 三峡大学 | 2020-06-16 | — | — | CN | disclosed |