Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Butane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Butane SCHEMBL27311306 | 0.94 | — | — | |
| Butane SCHEMBL7064528 | 0.94 | TSHR (0.36) | — | |
| Butane SCHEMBL27863151 | 0.89 | DNM1 (0.33) | — | |
| Butane SCHEMBL27863150 | 0.89 | DNM1 (0.33) | — | |
| Butane SCHEMBL5129860 | 0.82 | TSHR (0.44) | — | |
| Butane SCHEMBL27543855 | 0.82 | — | — | |
| Butane SCHEMBL8463912 | 0.82 | — | — | |
| Butane SCHEMBL8412888 | 0.82 | TSHR (0.44) | — | |
| Butane SCHEMBL9442188 | 0.82 | — | — | |
| Butane SCHEMBL2036217 | 0.82 | — | — |
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-6348622-B1 | CHEMICAL INTERMEDIATES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-02-19 | — | — | US | disclosed |
| EP-0900785-A2 | Vitamin A related compounds and process for producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-03-10 | — | — | EP | disclosed |