Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 4/20 | 0.35 |
| ▸ | F10 | P00742 | 4/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 4/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 4/20 | 0.35 |
| ▸ | SLC8A1 | P32418 | 9/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320544 | 0.75 | BRD4 (0.43) | ALDH1A1F2F10ITGB3PRSS1 | |
| Hydrochloric Acid SCHEMBL23320553 | 0.75 | PKN1 (0.34) | ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL23320557 | 0.75 | PKN1 (0.34) | ALDH1A1CYP1A2 | |
| SCHEMBL23320392 | 0.71 | ALDH1A1 (0.57) | ALDH1A1 | |
| SCHEMBL28635105 | 0.68 | CYP19A1 (0.49) | ALDH1A1SLC8A1CYP19A1ARMAOA | |
| SCHEMBL23320530 | 0.68 | CYP19A1 (0.49) | ALDH1A1SLC8A1CYP19A1ARMAOA | |
| SCHEMBL23320564 | 0.65 | NAMPT (0.53) | ALDH1A1F2F10PRSS1CYP19A1 | |
| SCHEMBL30943262 | 0.65 | MAOB (0.46) | ALDH1A1CYP19A1ARMAOAMAOB | |
| SCHEMBL18917071 | 0.64 | ROCK2 (0.68) | — | |
| SCHEMBL23320369 | 0.63 | QPCT (0.39) | ALDH1A1CYP1A2 |
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-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |