Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.54 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.49 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
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 SCHEMBL9841200 | 1.00 | NR5A1 (0.54) | NR5A1MEN1USP2ALDH1A1LMNA | |
| Fluoride SCHEMBL9842024 | 1.00 | NR5A1 (0.54) | NR5A1MEN1USP2ALDH1A1LMNA | |
| Fluoride SCHEMBL9841393 | 0.95 | LMNA (0.50) | MEN1USP2ALDH1A1LMNACYP3A4 | |
| SCHEMBL29962325 | 0.89 | NR5A1 (0.66) | NR5A1MEN1USP2ALDH1A1LMNA | |
| SCHEMBL11226743 | 0.89 | NR5A1 (0.66) | NR5A1LMNANPC1RAB9ATP53 | |
| SCHEMBL3841866 | 0.89 | NR5A1 (0.66) | NR5A1LMNANPC1RAB9ATP53 | |
| SCHEMBL8356940 | 0.89 | NR5A1 (0.66) | NR5A1LMNANPC1RAB9ATP53 | |
| SCHEMBL2097863 | 0.89 | NR5A1 (0.66) | NR5A1LMNANPC1RAB9ATP53 | |
| SCHEMBL12587660 | 0.89 | NR5A1 (0.66) | NR5A1MEN1USP2ALDH1A1LMNA | |
| Fluoride SCHEMBL9841761 | 0.89 | NR5A1 (0.57) | NR5A1MEN1USP2ALDH1A1LMNA |
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 |