Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Fluorobenzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | FBP1 | P09467 | 7/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| Fluorobenzene SCHEMBL31424944 | 0.95 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTKCNN4ALOX15 | |
| Fluorobenzene SCHEMBL11811518 | 0.95 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTKCNN4ALOX15 | |
| Nitric Acid SCHEMBL28200213 | 0.83 | CES2 (0.41) | ALDH1A1LMNAMAPTALOX15TSHR | |
| Fluorobenzene SCHEMBL27281600 | 0.79 | — | — | |
| Fluorobenzene SCHEMBL28200701 | 0.77 | KCNN4 (0.48) | ALDH1A1MAPTKCNN4TSHRRECQL | |
| Fluorobenzene SCHEMBL27416246 | 0.76 | ALDH1A1 (0.54) | ALDH1A1LMNAMAPTTSHRRECQL | |
| Nitrobenzene SCHEMBL5555846 | 0.76 | ALDH1A1 (0.76) | ALDH1A1LMNAMAPTALOX15TSHR | |
| Fluorobenzene SCHEMBL27335596 | 0.76 | NFE2L2 (0.46) | ALDH1A1KCNN4TSHR | |
| Fluorobenzene SCHEMBL27310946 | 0.76 | NFE2L2 (0.46) | ALDH1A1MAPTKCNN4ALOX15TSHR | |
| Fluorobenzene SCHEMBL28200162 | 0.75 | TSHR (0.46) | ALDH1A1LMNAMAPTKCNN4TSHR |
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-107663161-A | A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt | 上海惠和化德生物科技有限公司 | 2018-02-06 | — | — | CN | disclosed |