Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6675178 | 0.99 | KDM4E (0.44) | KDM4ERECQLNPSR1ALDH1A1S1PR1 | |
| SCHEMBL6679310 | 0.86 | KDM4E (0.40) | KDM4ERECQLNPSR1ALDH1A1MEN1 | |
| SCHEMBL7739635 | 0.84 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2ACYP2C19SMN1; SMN2 | |
| SCHEMBL6678474 | 0.83 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ACYP2C19SMN1; SMN2 | |
| SCHEMBL6675695 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KMT2ACYP2C19SMN1; SMN2CYP2C9 | |
| SCHEMBL6679306 | 0.83 | KDM4E (0.43) | KDM4ERECQLNPSR1ALDH1A1MEN1 | |
| SCHEMBL6688371 | 0.83 | KDM4E (0.41) | KDM4ERECQLNPSR1ALDH1A1MEN1 | |
| SCHEMBL6678436 | 0.82 | ALDH1A1 (0.40) | ALDH1A1KMT2ARAB9ANPC1GAA | |
| SCHEMBL6681804 | 0.82 | GRM2 (0.38) | ALDH1A1KMT2ASMN1; SMN2GAAMAPT | |
| SCHEMBL6682248 | 0.81 | ALDH1A1 (0.40) | ALDH1A1KMT2ACYP2C19SMN1; SMN2CYP2C9 |
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 |