Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 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 | |
|---|---|---|---|---|
| SCHEMBL9405964 | 1.00 | NPC1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9405808 | 0.99 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9405996 | 0.99 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9405999 | 0.99 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9405811 | 0.99 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9406184 | 0.97 | NPC1 (0.38) | NPC1HPGDGAAMAPTPPARG | |
| SCHEMBL9406180 | 0.97 | NPC1 (0.38) | NPC1HPGDGAAMAPTPPARG | |
| SCHEMBL9406066 | 0.97 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9406069 | 0.97 | CNR1 (0.37) | NPC1CNR1CNR2HPGDGAA | |
| SCHEMBL9405866 | 0.95 | CNR1 (0.39) | CNR1CNR2HPGDGAAMAPT |
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-5279764-A | Dihalogenobenzene derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-01-18 | — | — | US | disclosed |