Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL2454249 | 0.91 | KCNH2 (0.36) | KCNH2ROCK1MAOAMAOBCYP2C9 | |
| SCHEMBL2450020 | 0.91 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2450402 | 0.91 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2450023 | 0.91 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2451700 | 0.91 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2778723 | 0.87 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2446408 | 0.87 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2777420 | 0.87 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL16457167 | 0.87 | KCNH2 (0.34) | KCNH2ROCK1L3MBTL1MAOAMAOB | |
| SCHEMBL2777477 | 0.87 | KCNH2 (0.40) | KCNH2ROCK1L3MBTL1MAOAMAOB |
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-2364088-A1 | BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS | Biogen Idec MA Inc. (US) | 2011-09-14 | — | — | EP | claimed |
| WO-2010051030-A1 | BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS | BIOGEN IDEC MA INC. (US) | 2010-05-06 | — | — | WO | claimed |
| EP-2364088-A1 | BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS | Biogen Idec MA Inc. (US) | 2011-09-14 | — | — | EP | disclosed |
| WO-2010051030-A1 | BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS | BIOGEN IDEC MA INC. (US) | 2010-05-06 | — | — | WO | disclosed |