Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | KCNJ5 | P48544 | 2/20 | 0.32 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6679938 | 0.92 | NR1H4 (0.36) | MAPKAPK2ALDH1A1NR1H4MCHR1CYP17A1 | |
| SCHEMBL6675974 | 0.91 | CA1 (0.36) | MAPKAPK2KMT2AALDH1A1HPGDNR1H4 | |
| SCHEMBL6675630 | 0.90 | NR1H4 (0.35) | MAPKAPK2ALDH1A1HPGDNR1H4MCHR1 | |
| SCHEMBL6679119 | 0.89 | NR1H4 (0.35) | MAPKAPK2ALDH1A1NR1H4MCHR1CYP17A1 | |
| SCHEMBL6675977 | 0.89 | NR1H4 (0.35) | MAPKAPK2KMT2AALDH1A1HPGDNR1H4 | |
| SCHEMBL6681133 | 0.88 | NR1H4 (0.34) | MAPKAPK2ALDH1A1NR1H4MCHR1CYP17A1 | |
| SCHEMBL6684393 | 0.87 | NR1H4 (0.34) | MAPKAPK2ALDH1A1NR1H4MCHR1CYP17A1 | |
| SCHEMBL6686106 | 0.86 | NR1H4 (0.33) | MAPKAPK2ALDH1A1NR1H4MCHR1CYP17A1 | |
| SCHEMBL6682277 | 0.85 | KDM4E (0.39) | KMT2AALDH1A1HPGDNR1H4MEN1 | |
| SCHEMBL6682103 | 0.83 | AKT1 (0.37) | MAPKAPK2ALDH1A1NR1H4 |
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 |