Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.61 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.61 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.61 |
| ▸ | CDK1 | P06493 | 1/20 | 0.61 |
| ▸ | CSF1R | P07333 | 1/20 | 0.61 |
| ▸ | PRKACA | P17612 | 1/20 | 0.61 |
| ▸ | FLT1 | P17948 | 1/20 | 0.61 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.61 |
| ▸ | CDK2 | P24941 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | AKT1 | P31749 | 1/20 | 0.61 |
| ▸ | FLT4 | P35916 | 1/20 | 0.61 |
| ▸ | KDR | P35968 | 1/20 | 0.61 |
| ▸ | FLT3 | P36888 | 1/20 | 0.61 |
| ▸ | GSK3A | P49840 | 1/20 | 0.61 |
| ▸ | GSK3B | P49841 | 1/20 | 0.61 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL2164884 | 1.00 | ALDH1A1 (0.68) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL2164215 | 1.00 | ALDH1A1 (0.68) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL10425902 | 0.86 | ALDH1A1 (0.66) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL10425904 | 0.86 | ALDH1A1 (0.66) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL6174893 | 0.85 | NPC1 (0.68) | ALDH1A1LMNANPC1ROCK2ROCK1 | |
| SCHEMBL2171122 | 0.85 | NPC1 (0.68) | ALDH1A1LMNANPC1ROCK2ROCK1 | |
| SCHEMBL2171126 | 0.85 | NPC1 (0.68) | ALDH1A1LMNANPC1ROCK2ROCK1 | |
| SCHEMBL1101522 | 0.85 | ALDH1A1 (0.77) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL5968858 | 0.85 | ALDH1A1 (0.77) | ALDH1A1LMNANPC1ROCK2RPS6KA5 | |
| SCHEMBL751213 | 0.85 | ALDH1A1 (0.77) | ALDH1A1LMNANPC1ROCK2RPS6KA5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1554245-B1 | PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDSYNTHASE | ACTELION PHARMACEUTICALS LTD (CH) | 2012-09-26 | — | — | EP | disclosed |
| EP-1534676-B1 | PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDE SYNTHASE | ACTELION PHARMACEUTICALS LTD (CH) | 2012-09-12 | — | — | EP | disclosed |
| EP-1554245-A1 | PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDSYNTHASE | Oxford GlycoSciences (UK) Ltd (GB) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004007454-A1 | PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDSYNTHASE | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-01-22 | — | — | WO | disclosed |