Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9106245 | 0.90 | S1PR1 (0.50) | S1PR1S1PR5 | |
| SCHEMBL9106248 | 0.90 | S1PR1 (0.50) | S1PR1S1PR5 | |
| SCHEMBL16175489 | 0.87 | HRH3 (0.35) | S1PR1S1PR5PPARGPPARATP53 | |
| SCHEMBL16175628 | 0.86 | S1PR5 (0.42) | S1PR1S1PR5HRH3KDM4EHDAC1 | |
| SCHEMBL9107296 | 0.79 | S1PR1 (0.39) | S1PR1PPARGPPARAMAOB | |
| SCHEMBL9107301 | 0.79 | S1PR1 (0.39) | S1PR1PPARGPPARAMAOB | |
| SCHEMBL9103955 | 0.77 | S1PR5 (0.46) | S1PR1S1PR5 | |
| SCHEMBL9103950 | 0.77 | S1PR5 (0.46) | S1PR1S1PR5 | |
| SCHEMBL9103326 | 0.76 | S1PR1 (0.54) | S1PR1S1PR5 | |
| SCHEMBL9103332 | 0.76 | S1PR1 (0.54) | S1PR1S1PR5 |
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-2646018-B1 | NOVEL OXIME AZETIDINE DERIVATIVES AS SPHINGOSINE 1-PHOSPHATE (S1P) RECEPTOR MODULATORS | ALLERGAN INC (US) | 2014-10-22 | — | — | EP | claimed |