Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ADH4 | P08319 | 1/20 | 0.38 |
| ▸ | ADH7 | P40394 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.33 |
| ▸ | GAPDH | P04406 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | ACE2 | Q9BYF1 | 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 | |
|---|---|---|---|---|
| SCHEMBL1785771 | 0.79 | ADH1B (0.41) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL1784935 | 0.78 | ADH1B (0.44) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL9734928 | 0.76 | OPRM1 (0.37) | SMPD1OPRM1CA1TP53 | |
| SCHEMBL1782148 | 0.73 | TSHR (0.43) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL10788018 | 0.73 | OPRM1 (0.39) | SMPD1OPRM1TP53PTPN1 | |
| SCHEMBL1786274 | 0.71 | SPHK1 (0.52) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL7192299 | 0.70 | PTPN1 (0.49) | SMPD1MAPTTP53CA2PTPN1 | |
| SCHEMBL1409548 | 0.70 | ADH1B (0.47) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL1781451 | 0.69 | SPHK1 (0.55) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL1783266 | 0.69 | SPHK1 (0.55) | ADH1BADH1CADH1AADH4ADH7 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0024532-B2 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1984-08-15 | — | — | EP | claimed |
| US-4409402-A | FRAGRANCES; CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1983-10-11 | — | — | US | claimed |
| EP-0024532-B1 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1982-06-23 | — | — | EP | claimed |
| EP-0024532-A1 | Tert. butoxybutanales and butanoles and bis-tert. butoxy-pentanales and pentanoles, their production and their use as perfumes | BASF Aktiengesellschaft (DE) | 1981-03-11 | — | — | EP | claimed |
| EP-0024532-B2 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1984-08-15 | — | — | EP | disclosed |
| US-4418216-A | Bis-tert.-butoxypentanals and bis-tert.-butoxypentanols | BASF AKTIENGESELLSCHAFT (DE) | 1983-11-29 | — | — | US | disclosed |
| US-4409402-A | FRAGRANCES; CHEMICAL INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1983-10-11 | — | — | US | disclosed |
| EP-0024532-B1 | TERT. BUTOXYBUTANALES AND BUTANOLES AND BIS-TERT. BUTOXY-PENTANALES AND PENTANOLES, THEIR PRODUCTION AND THEIR USE AS PERFUMES | BASF Aktiengesellschaft (DE) | 1982-06-23 | — | — | EP | disclosed |
| EP-0024532-A1 | Tert. butoxybutanales and butanoles and bis-tert. butoxy-pentanales and pentanoles, their production and their use as perfumes | BASF Aktiengesellschaft (DE) | 1981-03-11 | — | — | EP | disclosed |