Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GUSB | P08236 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL6978415 | 0.89 | CNR1 (0.41) | TDP1CNR1NPC1MAPTCNR2 | |
| (2-Nitrovinyl)Benzene SCHEMBL8152119 | 0.79 | FBP1 (0.42) | ALDH1A1CNR1MEN1KMT2A | |
| SCHEMBL6974269 | 0.79 | CNR1 (0.41) | ALDH1A1CNR1NPC1RAB9ACNR2 | |
| SCHEMBL6969217 | 0.71 | SLC6A2 (0.36) | SLC6A2SLC6A4MEN1KMT2A | |
| SCHEMBL6974041 | 0.69 | SLC6A3 (0.35) | ALDH1A1TDP1CNR1MAPTSLC6A2 | |
| SCHEMBL6969488 | 0.68 | ALDH1A1 (0.47) | ALDH1A1TDP1NPC1RAB9AMAPT | |
| SCHEMBL6969479 | 0.68 | ALDH1A1 (0.47) | ALDH1A1TDP1NPC1RAB9AMAPT | |
| SCHEMBL6974296 | 0.68 | TDP1 (0.43) | ALDH1A1TDP1CA1MAPTMEN1 | |
| Hydrochloric Acid SCHEMBL6965397 | 0.67 | ALDH1A1 (0.46) | ALDH1A1TDP1NPC1RAB9AMAPT | |
| SCHEMBL6970982 | 0.66 | MEN1 (0.35) | ALDH1A1TDP1SLC6A2SLC6A4MEN1 |
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-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | claimed |