Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.43 |
| ▸ | HTR1B | P28222 | 7/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3869457 | 0.81 | ALDH1A1 (0.45) | ALDH1A1GLAMAPK14CA2MEN1 | |
| SCHEMBL15603433 | 0.81 | KDM4E (0.46) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL93314 | 0.79 | ALDH1A1 (0.62) | PDK1ALDH1A1GLAHTR1BHTR1D | |
| SCHEMBL5026215 | 0.79 | ALDH1A1 (0.62) | PDK1ALDH1A1GLAHTR1BHTR1D | |
| SCHEMBL5433989 | 0.79 | ALDH1A1 (0.62) | PDK1ALDH1A1GLAHTR1BHTR1D | |
| SCHEMBL29402954 | 0.79 | ALDH1A1 (0.62) | PDK1ALDH1A1GLAHTR1BHTR1D | |
| SCHEMBL10815255 | 0.78 | ALDH1A1 (0.43) | ALDH1A1GLAMAPK14CA2KDM4E | |
| SCHEMBL10817266 | 0.78 | ALDH1A1 (0.43) | ALDH1A1GLAMAPK14CA2KDM4E | |
| SCHEMBL10815263 | 0.78 | ALDH1A1 (0.43) | ALDH1A1GLAMAPK14CA2KDM4E | |
| SCHEMBL567323 | 0.78 | ADRA1D (0.50) | ALDH1A1MAPK14CA2MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0249610-B1 | SYNTHESIS OF OPTICALLY ACTIVE ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-08-25 | — | — | EP | disclosed |
| US-4990668-A | Reacting selected dioxolane with hydrohalic acid and organic acid, then with amine | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-02-05 | — | — | US | disclosed |
| EP-0249610-A4 | SYNTHESIS OF OPTICALLY ACTIVE ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES. | DU PONT (US) | 1990-02-21 | — | — | EP | disclosed |
| EP-0249610-A1 | SYNTHESIS OF OPTICALLY ACTIVE ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES. | DU PONT (US) | 1987-12-23 | — | — | EP | disclosed |
| WO-1987003584-A1 | SYNTHESIS OF OPTICALLY ACTIVE ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-06-18 | — | — | WO | disclosed |