Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11314786 | 1.00 | NPC1 (0.33) | NPC1ALDH1A1RAB9AEPHX1MAPT | |
| SCHEMBL11333113 | 0.85 | NOS3 (0.34) | EPHX1 | |
| SCHEMBL11333117 | 0.85 | NOS3 (0.34) | EPHX1 | |
| SCHEMBL18885680 | 0.82 | CA1 (0.35) | NPC1ALDH1A1RAB9AMAPT | |
| SCHEMBL11327094 | 0.82 | NOS3 (0.39) | NPC1ALDH1A1RAB9AEPHX1 | |
| SCHEMBL11327107 | 0.82 | NOS3 (0.39) | NPC1ALDH1A1RAB9AEPHX1 | |
| SCHEMBL11317764 | 0.79 | NOS3 (0.30) | — | |
| SCHEMBL11317759 | 0.79 | NOS3 (0.30) | — | |
| SCHEMBL11509259 | 0.79 | NPC1 (0.35) | NPC1ALDH1A1RAB9A | |
| SCHEMBL11578137 | 0.77 | — | — |
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-4254143-A | PARACITICIDES; LIVER FLUKES | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-03-03 | — | — | US | disclosed |