Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | C5AR1 | P21730 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.40 |
| ▸ | QRFPR | Q96P65 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6679970 | 0.87 | ALDH1A1 (0.45) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL7246442 | 0.86 | ALDH1A1 (0.44) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL7247258 | 0.86 | ALDH1A1 (0.56) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL6680596 | 0.81 | ALDH1A1 (0.46) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL6678684 | 0.80 | ALDH1A1 (0.43) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL27389055 | 0.79 | GAA (0.44) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL6675050 | 0.79 | ALDH1A1 (0.45) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL6678686 | 0.79 | ALDH1A1 (0.43) | ALDH1A1GAALMNAKMT2AKDM4E | |
| SCHEMBL6675923 | 0.78 | KDM4E (0.45) | ALDH1A1GAAKDM4E | |
| SCHEMBL7244882 | 0.78 | ALDH1A1 (0.44) | ALDH1A1GAALMNAKMT2AIMPDH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | disclosed |
| US-6534546-B1 | Guanidine- or isothioureido-N-derived anilines; brain, nervous system, and neurodegenerative disorders | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2003-03-18 | — | — | US | disclosed |
| EP-0798292-A1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | Chugai Seiyaku Kabushiki Kaisha (JP) | 1997-10-01 | — | — | EP | disclosed |