Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.32 |
| ▸ | CHIT1 | Q13231 | 3/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.31 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7243106 | 0.76 | SIGMAR1 (0.39) | NOS3NOS1NOS2SIGMAR1AURKA | |
| SCHEMBL6676936 | 0.68 | SIGMAR1 (0.45) | NOS3NOS1NOS2ALDH1A1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL6682202 | 0.67 | SIGMAR1 (0.46) | NOS3NOS1NOS2ALDH1A1SIGMAR1 | |
| SCHEMBL15171105 | 0.63 | PTGES (0.40) | AURKARPS6KB1 | |
| SCHEMBL16709846 | 0.62 | HDAC3 (0.43) | CA1CA2AURKARPS6KB1 | |
| SCHEMBL6678030 | 0.62 | SIGMAR1 (0.44) | NOS3NOS1NOS2SIGMAR1GRIN2D | |
| SCHEMBL6676657 | 0.62 | CYP3A4 (0.47) | CA1CA2NOS3NOS1NOS2 | |
| SCHEMBL6679168 | 0.61 | ADRA2A (0.43) | NOS3NOS1NOS2SIGMAR1GRIN2D | |
| SCHEMBL16709841 | 0.61 | HDAC1 (0.42) | CA1CA2AURKARPS6KB1 | |
| SCHEMBL23455338 | 0.60 | NPC1 (0.48) | CA2MEN1KMT2AALDH1A1CHIT1 |
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 1 patent. 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 |