Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 3/20 | 0.38 |
| ▸ | NOS2 | P35228 | 3/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CCNC | P24863 | 3/20 | 0.35 |
| ▸ | CDK8 | P49336 | 3/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17012194 | 0.82 | PDE3B (0.42) | SIRT3TDP1LIMK1NOS3NOS2 | |
| SCHEMBL30631992 | 0.82 | NOS3 (0.48) | SIRT3TDP1LIMK1NOS3NOS2 | |
| SCHEMBL14284234 | 0.82 | KDM4E (0.46) | TDP1KDM4ELMNAL3MBTL1ALDH1A1 | |
| SCHEMBL1437221 | 0.82 | NOS3 (0.48) | SIRT3TDP1LIMK1NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL16741076 | 0.80 | NOS3 (0.47) | SIRT3TDP1LIMK1NOS3NOS2 | |
| SCHEMBL11870742 | 0.80 | SIRT3 (0.44) | SIRT3TDP1LIMK1NOS3NOS2 | |
| Water SCHEMBL21833988 | 0.80 | NOS3 (0.47) | SIRT3TDP1LIMK1NOS3NOS2 | |
| SCHEMBL15757457 | 0.80 | NOS2 (0.52) | SIRT3TDP1LIMK1NOS3NOS2 | |
| SCHEMBL4220452 | 0.79 | KDM4E (0.41) | LCKKDM4EADORA3ADORA2AL3MBTL1 | |
| SCHEMBL22923830 | 0.78 | SIRT3 (0.43) | SIRT3TDP1LIMK1NOS3NOS2 |
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-1486489-B1 | Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation | DOW AGROSCIENCES LLC (US) | 2016-04-27 | — | — | EP | disclosed |