Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2452544 | 0.91 | KCNH2 (0.35) | KCNH2ROCK1MAPTPTPN1IKBKB | |
| SCHEMBL2454617 | 0.90 | KCNH2 (0.41) | KCNH2ROCK1ALDH1A1LMNAMAPT | |
| SCHEMBL2775431 | 0.90 | KCNH2 (0.41) | KCNH2ROCK1ALDH1A1LMNAMAPT | |
| SCHEMBL2777420 | 0.83 | KCNH2 (0.40) | KCNH2ROCK1LMNAMAOAMAOB | |
| SCHEMBL2778723 | 0.83 | KCNH2 (0.40) | KCNH2ROCK1LMNAMAOAMAOB | |
| SCHEMBL16457231 | 0.83 | KCNH2 (0.34) | KCNH2ROCK1PTPN1IKBKBMAOA | |
| SCHEMBL16457168 | 0.83 | KCNH2 (0.34) | KCNH2ROCK1PTPN1IKBKBMAOA | |
| SCHEMBL16457167 | 0.83 | KCNH2 (0.34) | KCNH2ROCK1PTPN1IKBKBMAOA | |
| SCHEMBL2777477 | 0.83 | KCNH2 (0.40) | KCNH2ROCK1LMNAMAOAMAOB | |
| SCHEMBL2446408 | 0.83 | KCNH2 (0.40) | KCNH2ROCK1LMNAMAOAMAOB |
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-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 |