Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL70458 | 1.00 | ACHE (0.48) | ACHECA1CA2MAPTKDM4E | |
| SCHEMBL29372751 | 1.00 | ACHE (0.48) | ACHECA1CA2MAPTKDM4E | |
| Methoxymethane SCHEMBL7620185 | 0.92 | CYP3A4 (0.46) | ACHECA1CA2MAPTKDM4E | |
| Bicarbonate SCHEMBL28002530 | 0.90 | MAPT (0.45) | ACHECA1CA2MAPTKDM4E | |
| SCHEMBL8857032 | 0.90 | CA1 (0.46) | ACHECA1CA2MAPTKDM4E | |
| Bicarbonate SCHEMBL11611153 | 0.90 | MAPT (0.45) | ACHECA1CA2MAPTKDM4E | |
| Acetic Acid SCHEMBL8016975 | 0.88 | MAPT (0.43) | ACHECA1CA2MAPTKDM4E | |
| Acetic Acid SCHEMBL5042427 | 0.88 | MAPT (0.43) | ACHECA1CA2MAPTKDM4E | |
| Acetic Acid SCHEMBL30315835 | 0.88 | MAPT (0.43) | ACHECA1CA2MAPTKDM4E | |
| SCHEMBL11430528 | 0.86 | TRPA1 (0.54) | ACHECA1CA2MAPTKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011128018-A1 | PROCESS FOR THE PREPARATION OF HYDROQUINONES | MERCK PATENT GMBH (DE) | 2011-10-20 | — | — | WO | disclosed |