Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 16/20 | 0.69 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.69 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.52 |
| ▸ | RELA | Q04206 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL320617 | 0.91 | S1PR1 (0.67) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL320618 | 0.91 | S1PR1 (0.67) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL320407 | 0.89 | S1PR1 (0.70) | S1PR1S1PR3NPC1NFKB1NFKB2 | |
| SCHEMBL14916846 | 0.88 | S1PR1 (0.67) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL9968839 | 0.87 | S1PR1 (0.65) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL2806793 | 0.87 | S1PR1 (0.71) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL410568 | 0.87 | S1PR1 (0.68) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL15905722 | 0.87 | S1PR1 (0.64) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL13187540 | 0.87 | S1PR1 (0.67) | S1PR1S1PR3NPC1NFKB1RAB9A | |
| SCHEMBL409297 | 0.87 | S1PR1 (0.66) | S1PR1S1PR3NPC1NFKB1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2590956-A1 | 5-(BIPHENYL-4-YL)-3-PHENYL-1,2,4-OXADIAZOLYL DERIVATIVES AS LIGANDS ON THE SPHINGOSINE 1-PHOSPHATE (S1P) RECEPTORS | Merck Serono S.A. (CH) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012004287-A1 | 5-(BIPHENYL-4-YL)-3-PHENYL-1,2,4-OXADIAZOLYL DERIVATIVES AS LIGANDS ON THE SPHINGOSINE 1-PHOSPHATE (S1P) RECEPTORS | MERCK SERONO S.A. (CH) | 2012-01-12 | — | — | WO | disclosed |