Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11505237 | 0.78 | ELANE (0.39) | ATML3MBTL1ELANESLC6A3SLC6A2 | |
| SCHEMBL2026805 | 0.78 | SLC6A3 (0.56) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL6699923 | 0.76 | CHRNB4 (0.40) | SLC6A3SLC6A2SLC6A4ALDH1A1LMNA | |
| SCHEMBL4954489 | 0.75 | CPB2 (0.31) | TSHR | |
| Hydrochloric Acid SCHEMBL15572916 | 0.74 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL6598508 | 0.73 | ALDH1A1 (0.39) | ATML3MBTL1ELANEALDH1A1TDP1 | |
| SCHEMBL27751192 | 0.70 | ELANE (0.47) | ATML3MBTL1ELANESLC6A3ALDH1A1 | |
| SCHEMBL8980223 | 0.69 | ALDH1A1 (0.35) | ATML3MBTL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL28006801 | 0.68 | ALDH1A1 (0.51) | ATML3MBTL1ELANEALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL6683095 | 0.67 | EPHX1 (0.38) | SLC6A3SLC6A2SLC6A4ALDH1A1LMNA |
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-114907288-A | Application of nitrobenzene compounds in preparation of pseudomonas aeruginosa quorum sensing inhibitor | 中国医学科学院医药生物技术研究所 | 2022-08-16 | — | — | CN | disclosed |