Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 5/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | RARB | P10826 | 4/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9329245 | 0.96 | NPC1 (0.62) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9513363 | 0.96 | NPC1 (0.62) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL11615110 | 0.86 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL11616642 | 0.85 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL11614672 | 0.85 | RAB9A (0.68) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9745673 | 0.84 | RARB (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9746155 | 0.84 | RARB (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9744731 | 0.84 | RARB (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9745033 | 0.84 | RARB (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E | |
| SCHEMBL9745265 | 0.84 | RARB (0.56) | NPC1RAB9ASMN1; SMN2HSD17B10KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4066570-A | OPTICAL CELLS, NEMATIC MIXTURES, LIQUID CRYSTALS | HOFFMAN-LA ROCHE INC. (US) | 1978-01-03 | — | — | US | disclosed |
| US-3997536-A | LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1976-12-14 | — | — | US | disclosed |