Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9265704 | 0.84 | LTA4H (0.51) | LMNAKDM4EMAPTHTR1AADRA1D | |
| SCHEMBL3301381 | 0.84 | ABCB1 (0.60) | KDM4EHTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL3306584 | 0.82 | SMN1; SMN2 (0.54) | RAB9ALMNAKDM4EL3MBTL1ABCB1 | |
| SCHEMBL11434004 | 0.80 | CYP19A1 (0.50) | RAB9AKDM4EMAPTHTR1AADRA1D | |
| SCHEMBL9185713 | 0.77 | CA2 (0.61) | RAB9AKDM4EABCB1ABCG2GAA | |
| SCHEMBL27950805 | 0.76 | BCHE (0.50) | RAB9AKDM4EHTR1AADRA1DADRA1A | |
| SCHEMBL27950804 | 0.75 | SLC5A1 (0.44) | RAB9AKDM4EMAPTL3MBTL1HTR1A | |
| SCHEMBL7649026 | 0.74 | KDM4E (0.70) | RAB9AKDM4EL3MBTL1HTR1AABCB1 | |
| SCHEMBL7000988 | 0.74 | ROCK2 (0.48) | ROCK2ROCK1RAB9AKDM4EMAPT | |
| SCHEMBL8092420 | 0.74 | KMT2A (0.54) | ROCK2ROCK1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1734037-A2 | Processes for the preparation of (R)-alpha-(2,3-dimethoxyphenyl)-1-[2-(4-fluorophenyl)ethyl]-4-piperidinemethanol\ | Aventis Pharmaceuticals Inc. (US) | 2006-12-20 | — | — | EP | disclosed |