Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL5933717 | 1.00 | — | — | |
| Alcohol SCHEMBL27972143 | 1.00 | ALDH1A1 (0.67) | ALDH1A1TSHRFFAR3SMN1; SMN2EPHX1 | |
| Cyclopentane SCHEMBL9633004 | 1.00 | ALDH1A1 (0.67) | ALDH1A1TSHRFFAR3SMN1; SMN2EPHX1 | |
| Cyclohexane SCHEMBL12482623 | 1.00 | ALDH1A1 (0.67) | ALDH1A1TSHRFFAR3SMN1; SMN2EPHX1 | |
| Cycloheptane SCHEMBL14721149 | 1.00 | ALDH1A1 (0.67) | ALDH1A1TSHRFFAR3SMN1; SMN2EPHX1 | |
| Cyclopropane SCHEMBL322401 | 1.00 | — | — | |
| Alcohol SCHEMBL3968617 | 1.00 | ALDH1A1 (0.67) | ALDH1A1TSHRFFAR3SMN1; SMN2EPHX1 | |
| Cyclohexane SCHEMBL959934 | 1.00 | — | — | |
| Cyclopropane SCHEMBL1923331 | 1.00 | — | — | |
| Cyclopentane SCHEMBL5158267 | 1.00 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5147586-A | Hydrocarbon and solvent, air pollution control | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-09-15 | — | — | US | disclosed |