Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3656901 | 0.88 | NPSR1 (0.41) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14755443 | 0.84 | MAPT (0.43) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5702129 | 0.82 | CA3 (0.33) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL935010 | 0.82 | MEN1 (0.38) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9952911 | 0.81 | CYP3A4 (0.35) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6830840 | 0.79 | PTPN1 (0.34) | KDM4ETDP1 | |
| SCHEMBL10225867 | 0.77 | MEN1 (0.39) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL15797295 | 0.77 | MEN1 (0.32) | NPSR1CYP3A4KDM4EALDH1A1MAPT | |
| SCHEMBL1498785 | 0.77 | ALDH1A1 (0.43) | CYP1A2CYP3A4HPGDKDM4EALDH1A1 | |
| SCHEMBL5610706 | 0.77 | ALDH1A1 (0.43) | CYP3A4HPGDKDM4EALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1673366-A1 | 1-\"2-(4-HYDROXYPHENYL)-2-HYDROXYETHYL]-PIPERIDIN-4-OL COMPOUNDS AS NMDA RECEPTOR ANTAGONISTS | Pfizer, Inc. (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005035522-A1 | 1-‘2-(4-HYDROXYPHENYL)-2-HYDROXYETHYL!-PIPERIDIN-4-OL COMPOUNDS AS NMDA RECEPTOR ANTAGONISTS | PFIZER JAPAN, INC. (JP) | 2005-04-21 | — | — | WO | disclosed |