Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 3/20 | 0.44 |
| ▸ | MMP1 | P03956 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP8 | P22894 | 2/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 5/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6681977 | 0.82 | AKT1 (0.43) | AKT1MMP1MMP2MMP9MMP8 | |
| SCHEMBL6679736 | 0.82 | GLS (0.46) | MMP1MMP2MMP9MMP8MMP13 | |
| SCHEMBL6681292 | 0.80 | AKT1 (0.49) | AKT1MMP1MMP2MMP9MMP8 | |
| SCHEMBL6681909 | 0.79 | AKT1 (0.51) | AKT1MMP1MMP2MMP9MMP8 | |
| SCHEMBL6679466 | 0.77 | KDM1A (0.43) | — | |
| Acetic Acid SCHEMBL6681849 | 0.75 | KDM1A (0.43) | BACE1 | |
| SCHEMBL6690431 | 0.75 | BACE1 (0.41) | AKT1BACE1AURKARPS6KB1 | |
| SCHEMBL6676802 | 0.74 | AKT1 (0.55) | AKT1BACE1CTSLCTSBCTSS | |
| SCHEMBL6689701 | 0.74 | RXFP1 (0.42) | MMP1MMP2MMP9MMP8MMP13 | |
| SCHEMBL1402743 | 0.74 | AKT1 (0.57) | AKT1CTSLCTSBCTSS |
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 |