Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.37 |
| ▸ | ABAT | P80404 | 1/20 | 0.37 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Formamide SCHEMBL4091594 | 0.83 | NOS2 (0.50) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| SCHEMBL7488 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL27389327 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| Ammonia Solution, Strong SCHEMBL22612697 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| Iodide SCHEMBL27713885 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| Iodide SCHEMBL11070568 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| Bromide SCHEMBL10623434 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| Fluoride SCHEMBL2020932 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E | |
| SCHEMBL29125217 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL1936574 | 0.80 | NOS2 (0.54) | CYP2A6ALDH1A1NOS3NOS2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4540770-A | Polystyrylpyridine resins having an increased toughness, and composite materials comprising these resins | SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) | 1985-09-10 | — | — | US | disclosed |