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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| Ethane SCHEMBL18759198 | 0.94 | TDP1 (0.35) | TDP1TSHRCA4ACHECA12 | |
| Hydrochloric Acid SCHEMBL8118405 | 0.94 | TDP1 (0.39) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL28807723 | 0.94 | TSHR (0.39) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL372202 | 0.94 | TSHR (0.39) | TDP1TSHRCA4ACHECA12 | |
| Hydrochloric Acid SCHEMBL719621 | 0.94 | TDP1 (0.39) | TDP1TSHRCA4ACHECA12 | |
| Hydrochloric Acid SCHEMBL3190347 | 0.94 | TDP1 (0.39) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL2219423 | 0.94 | TSHR (0.39) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL27367403 | 0.90 | TSHR (0.37) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL28216822 | 0.90 | TSHR (0.37) | TDP1TSHRCA4ACHECA12 | |
| Ethane SCHEMBL27485242 | 0.90 | TSHR (0.37) | TDP1TSHRCA4ACHECA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0521449-B1 | Process for producing pyrethrolone and its intermediate compound | SUMITOMO CHEMICAL CO (JP) | 1996-11-06 | — | — | EP | disclosed |
| US-5225605-A | PROCESS FOR PRODUCING PYRETHROLONE AND ITS INTERMEDIATE COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-07-06 | — | — | US | disclosed |
| EP-0521449-A2 | Process for producing pyrethrolone and its intermediate compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-01-07 | — | — | EP | disclosed |