Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Ethane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL8633350 | 0.94 | CYP3A4 (0.31) | — | |
| Ethane SCHEMBL8636149 | 0.83 | — | — | |
| Propane SCHEMBL8632266 | 0.83 | CYP11B1 (0.31) | CYP11B1CYP11B2 | |
| Ethane SCHEMBL8633247 | 0.82 | — | — | |
| Hexane SCHEMBL8633801 | 0.82 | CYP3A4 (0.31) | — | |
| Hexane SCHEMBL8632251 | 0.78 | CYP3A4 (0.31) | — | |
| Hydrochloric Acid SCHEMBL29564384 | 0.77 | CYP11B1 (0.33) | CYP11B1CYP11B2 | |
| Ethane SCHEMBL8632942 | 0.76 | PDCD1 (0.31) | — | |
| Ethane SCHEMBL8634266 | 0.75 | — | — | |
| Ethane SCHEMBL8631684 | 0.75 | KDM4E (0.37) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | claimed |
| US-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | disclosed |