Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 5/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29462674 | 0.83 | ALDH1A1 (0.55) | ALDH1A1TAAR1HTTGAAGRM5 | |
| SCHEMBL30325664 | 0.83 | TAAR1 (0.59) | ALDH1A1TAAR1HTTGAAGRM5 | |
| SCHEMBL3793523 | 0.82 | TAAR1 (0.52) | ALDH1A1TAAR1HTTGAAGRM5 | |
| SCHEMBL21088010 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TAAR1HTTGAABACE1 | |
| SCHEMBL28228447 | 0.81 | TDP1 (0.46) | ALDH1A1GRM5 | |
| SCHEMBL17867987 | 0.81 | TSHR (0.46) | ALDH1A1HTTGAAGRM5KDM4E | |
| SCHEMBL3785218 | 0.80 | ALDH1A1 (0.54) | ALDH1A1TAAR1HTTGAAGRM5 | |
| SCHEMBL400327 | 0.77 | ALDH1A1 (0.56) | ALDH1A1TAAR1GAAGRM5L3MBTL1 | |
| SCHEMBL2501033 | 0.77 | ALDH1A1 (0.45) | ALDH1A1TAAR1HTTGAACYP1A1 | |
| SCHEMBL13192479 | 0.77 | ESR2 (0.47) | ALDH1A1 |
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-105272903-B | Series fluorosurfactants carbazole compound and its preparation method and application | 江苏师范大学 | 2018-07-10 | — | — | CN | disclosed |