Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8008448 | 1.00 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| Alcohol SCHEMBL7938333 | 0.96 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| Alcohol SCHEMBL7938331 | 0.96 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL11402672 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL10782837 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL8015610 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL10782842 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL8015613 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL11789874 | 0.77 | ALDH1A1 (0.47) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 | |
| SCHEMBL8022949 | 0.77 | ALDH1A1 (0.47) | ALDH1A1LMNAHSD17B10ALOX15PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6018075-A | BY REACTING GAMMA-BROMOTIGLIC ALDEHYDE OR GAMMA-CHLOROTIGLIC ALDEHYDE WITH SODIUM OR POTASSIUM ACETATE IN THE PRESENCE OF A PHASE TRANSFER CATALYST AND ORGANIC SOLVENT | ROCHE VITAMINS INC. (US) | 2000-01-25 | — | — | US | disclosed |
| US-5990360-A | DEETHERIFICATION IN PRESENCE OF AN ALUMINIUM SILICATE CATALYST | ROCHE VITAMINS INC. (US) | 1999-11-23 | — | — | US | disclosed |
| US-5786518-A | HALOHYDROXYLATION OF ALKOXY-2-METHYL-1,3-BUTADIENE WITH ALKANOL AND HALOGEN THEN HYDROLYSIS | ROCHE VITAMINS INC. (US) | 1998-07-28 | — | — | US | disclosed |