Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.57 |
| ▸ | RAB9A | P51151 | 6/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | RARB | P10826 | 4/20 | 0.49 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LTA4H | P09960 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | ACACA | Q13085 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7883583 | 0.95 | NPC1 (0.63) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL8748382 | 0.89 | NPC1 (0.62) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL8748572 | 0.88 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL7877116 | 0.88 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL6534975 | 0.88 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL7506953 | 0.88 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL9513828 | 0.88 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL8748576 | 0.88 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL8748612 | 0.87 | NPC1 (0.63) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL8748345 | 0.87 | NPC1 (0.63) | NPC1RAB9ASMN1; SMN2KDM4EHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0754685-A2 | Derivatives from alkoxyalkoxy substituted nitrogen containing hetero rings | Rolic AG (CH) | 1997-01-22 | — | — | EP | disclosed |