Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.47 |
| ▸ | CRBN | Q96SW2 | 4/20 | 0.45 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL88886 | 1.00 | — | — | |
| SCHEMBL30957985 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL29778326 | 0.96 | OR51E2 (0.45) | OR51E2CRBNFKBP5 | |
| SCHEMBL279773 | 0.92 | — | — | |
| SCHEMBL540697 | 0.89 | — | — | |
| SCHEMBL821040 | 0.89 | CRBN (0.50) | OR51E2CRBNFKBP5KDM4EGAA | |
| SCHEMBL820531 | 0.89 | CRBN (0.50) | OR51E2CRBNFKBP5KDM4EGAA | |
| SCHEMBL21423158 | 0.89 | CRBN (0.50) | OR51E2CRBNFKBP5KDM4EGAA | |
| SCHEMBL8089176 | 0.89 | CRBN (0.50) | OR51E2CRBNFKBP5KDM4EGAA | |
| SCHEMBL820411 | 0.89 | CRBN (0.50) | OR51E2CRBNFKBP5KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008027075-A2 | SULFHYDRYL-REACTIVE, WATER SOLUBLE DYES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2008-03-06 | — | — | WO | disclosed |
| EP-0962457-B1 | Piperidones as tachykinin antagonists | PFIZER LTD (GB) | 2003-08-06 | — | — | EP | disclosed |
| EP-0790248-B1 | 3-Aza-piperidone- (tetrahydropyrimidin-2-one) and 3-oxa-piperidone (1,3 oxazin-2-one) derivatives, their preparation and their use as tachykinin/neurokinin antagonists | PFIZER LTD (GB) | 2003-05-28 | — | — | EP | disclosed |
| EP-0790248-A1 | 3-Aza-piperidone- (tetrahydropyrimidin-2-one) and 3-oxa-piperidone (1,3 oxazin-2-one) derivatives, their preparation and their use as tachykinin/neurokinin antagonists | Pfizer Limited (GB) | 1997-08-20 | — | — | EP | disclosed |