Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 10/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 3/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2410408 | 1.00 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2411105 | 1.00 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2410163 | 1.00 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2408735 | 1.00 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2408732 | 1.00 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2408835 | 0.94 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2408838 | 0.94 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2409496 | 0.94 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2414167 | 0.94 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 | |
| SCHEMBL2416443 | 0.94 | GSR (0.44) | GSRCA2MAPTBCHECHRNB2 |
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-2369924-A1 | NITROOXY CYCLOALKANE DERIVATIVES | Merck Sharp & Dohme Corp. (US) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010062415-A1 | NITROOXY CYCLOALKANE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2010-06-03 | — | — | WO | disclosed |