Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.54 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.50 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.48 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.48 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9841202 | 1.00 | LTA4H (0.54) | LTA4HCHRNB4CHRNA3CHRNA7S1PR4 | |
| Fluoride SCHEMBL9842040 | 1.00 | LTA4H (0.54) | LTA4HCHRNB4CHRNA3CHRNA7S1PR4 | |
| Fluoride SCHEMBL9841491 | 0.99 | LTA4H (0.55) | LTA4HCHRNB4CHRNA3CHRNA7S1PR4 | |
| Fluoride SCHEMBL9841395 | 0.96 | CHRNB4 (0.54) | LTA4HCHRNB4CHRNA3CHRNA7MEN1 | |
| Fluoride SCHEMBL9841489 | 0.90 | CHRNB4 (0.54) | LTA4HCHRNB4CHRNA3CHRNA7CYP3A4 | |
| Fluoride SCHEMBL9841351 | 0.86 | CYP3A4 (0.53) | CYP3A4ALDH1A1LMNAMAPK1TP53 | |
| Fluoride SCHEMBL9841857 | 0.86 | CYP3A4 (0.53) | CYP3A4ALDH1A1LMNAMAPK1TP53 | |
| SCHEMBL9615390 | 0.86 | LTA4H (0.62) | LTA4HCYP3A4ALDH1A1LMNAMAPK1 | |
| Fluoride SCHEMBL9841646 | 0.85 | ALDH1A1 (0.53) | LTA4HCHRNB4CHRNA3CHRNA7CYP3A4 | |
| Fluoride SCHEMBL9841828 | 0.85 | CYP3A4 (0.54) | CYP3A4ALDH1A1LMNAMAPK1TP53 |
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-5055223-A | For use in liquid crystal display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-10-08 | — | — | US | disclosed |