Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | DRD5 | P21918 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7307142 | 0.88 | ACHE (0.41) | ACHEDRD1DRD5KDM4EALDH1A1 | |
| SCHEMBL7439704 | 0.79 | CYP2D6 (0.41) | ACHEDRD1DRD5KDM4EALDH1A1 | |
| SCHEMBL7447187 | 0.76 | DRD1 (0.39) | DRD1DRD5KDM4EALDH1A1HPGD | |
| SCHEMBL7444629 | 0.76 | DRD1 (0.39) | DRD1DRD5KDM4EALDH1A1HPGD | |
| SCHEMBL8829448 | 0.76 | ACHE (0.39) | ACHEDRD1DRD5KDM4EALDH1A1 | |
| SCHEMBL7319817 | 0.73 | DRD2 (0.44) | ACHEMEN1KMT2A | |
| SCHEMBL7313225 | 0.66 | ALDH1A1 (0.55) | ACHEKDM4EALDH1A1HPGDMEN1 | |
| SCHEMBL613008 | 0.65 | ACHE (0.44) | ACHEKDM4EALDH1A1HPGDCA1 | |
| Hydrochloric Acid SCHEMBL11709738 | 0.65 | DRD1 (0.55) | DRD1DRD5KDM4EALDH1A1HPGD | |
| SCHEMBL7445334 | 0.64 | DRD1 (0.38) | DRD1DRD5KDM4ECA1CA2 |
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-5621133-A | PREPARING A 1-(3,4-DIALKOXYPHENYL),3-HYDROXYALKANE(C6-C12) BY EPOXIDIZING A HALO DERIVATIVE WITH A BASE FOLLOWED BY DECYCLICIZING WITH AN ORGANOMETALLIC COMPOUND IN A SOLVENT; NAPHTHYLENES, ISOCHROMENES AND ISOTHIOCHROMENES | DENINNO MICHAEL P (US) | 1997-04-15 | — | — | US | disclosed |
| US-5591884-A | PROTECTED HYDROXYALKYLCATECHOL INTERMEDIATES | ABBOTT LABORATORIES (US) | 1997-01-07 | — | — | US | disclosed |