Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Cyclohexane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.77 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.77 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL28811591 | 0.97 | ALDH1A1 (0.81) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL27751993 | 0.94 | ALDH1A1 (0.77) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL29709419 | 0.91 | ALDH1A1 (0.93) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL18062502 | 0.91 | ALDH1A1 (0.93) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL3759526 | 0.91 | ALDH1A1 (0.93) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL3759531 | 0.91 | — | — | |
| Imidazole SCHEMBL18062503 | 0.91 | — | — | |
| Imidazole SCHEMBL187162 | 0.91 | — | — | |
| Imidazole SCHEMBL3767595 | 0.91 | ALDH1A1 (0.93) | ALDH1A1FKBP5 | |
| Imidazole SCHEMBL28274251 | 0.91 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115400799-A | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2022-11-29 | — | — | CN | claimed |
| CN-115400799-B | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2023-08-01 | — | — | CN | disclosed |
| CN-115400799-A | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2022-11-29 | — | — | CN | disclosed |