Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NR1D1 | P20393 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7876745 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HTTNR1D1POLBRAB9A | |
| SCHEMBL7872378 | 0.86 | ALDH1A1 (0.41) | ALDH1A1HTTNR1D1POLBRAB9A | |
| SCHEMBL6676029 | 0.85 | TDP1 (0.46) | ALDH1A1HTTNR1D1NPSR1POLB | |
| SCHEMBL283204 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1HTTNR1D1NPSR1POLB | |
| SCHEMBL6679943 | 0.84 | NR1D1 (0.40) | ALDH1A1HTTNR1D1NPSR1RAB9A | |
| SCHEMBL6676172 | 0.81 | KMT2A (0.38) | ALDH1A1HTTPOLBSNCALMNA | |
| SCHEMBL6677867 | 0.79 | KDM4E (0.36) | ALDH1A1HTTPOLBRAB9ALMNA | |
| SCHEMBL1625905 | 0.77 | BMP1 (0.47) | ALDH1A1NR1D1POLBRAB9ATDP1 | |
| SCHEMBL1627019 | 0.77 | TSHR (0.44) | ALDH1A1NR1D1MAPTTSHR | |
| SCHEMBL5191594 | 0.76 | SNCA (0.49) | ALDH1A1NR1D1SNCATDP1MAPT |
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 |