Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 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 | |
|---|---|---|---|---|
| SCHEMBL28692969 | 1.00 | ALOX5 (0.37) | ALOX5PTGS2KMT2AMYCXDH | |
| SCHEMBL29385162 | 0.90 | KMT2A (0.42) | KMT2AL3MBTL1HAO1KDM4EALDH1A1 | |
| SCHEMBL28673356 | 0.90 | KMT2A (0.42) | KMT2AL3MBTL1HAO1KDM4EALDH1A1 | |
| SCHEMBL28703771 | 0.83 | HTR6 (0.43) | KMT2AMYCL3MBTL1ALDH1A3GABRA1 | |
| SCHEMBL29429046 | 0.83 | HTR6 (0.43) | KMT2AMYCL3MBTL1ALDH1A3GABRA1 | |
| SCHEMBL29429024 | 0.83 | HTR6 (0.43) | KMT2AMYCL3MBTL1ALDH1A3GABRA1 | |
| SCHEMBL28677446 | 0.81 | HAO1 (0.42) | KMT2AL3MBTL1HAO1KDM4EALDH1A1 | |
| SCHEMBL29386586 | 0.81 | HAO1 (0.42) | KMT2AL3MBTL1HAO1KDM4EALDH1A1 | |
| SCHEMBL28681075 | 0.79 | KCNH2 (0.41) | KDRKDM4EALDH1A1MAPTCYP11B1 | |
| SCHEMBL29385594 | 0.79 | KCNH2 (0.41) | KDRKDM4EALDH1A1MAPTCYP11B1 |
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-114031613-A | 1- (benzo [ b ] thiophene-7-yl) -indole derivative and synthetic method thereof | 湖南第一师范学院 | 2022-02-11 | — | — | CN | disclosed |