Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KCNQ3 | O43525 | 3/20 | 0.35 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9737283 | 0.83 | PTGDR2 (0.47) | MYCPTGS2PTGDR2RAB9AALDH1A1 | |
| SCHEMBL9737491 | 0.82 | PTGS2 (0.41) | MYCPTGS2KCNQ3KCNQ2PTGDR2 | |
| SCHEMBL9737572 | 0.80 | TSPO (0.45) | MYCPTGS2KCNQ3KCNQ2ALDH1A1 | |
| SCHEMBL9737185 | 0.80 | KCNQ3 (0.41) | MYCPTGS2KCNQ3KCNQ2IRAK4 | |
| SCHEMBL9737163 | 0.79 | ALDH1A1 (0.43) | MYCPTGS2L3MBTL1ALDH1A1 | |
| SCHEMBL9738542 | 0.77 | TSPO (0.44) | — | |
| SCHEMBL18116342 | 0.73 | HTR1B (0.44) | — | |
| SCHEMBL9737699 | 0.73 | PTGDR2 (0.46) | PTGS2KCNQ3KCNQ2PTGDR2IRAK4 | |
| SCHEMBL9737634 | 0.71 | KDM4E (0.48) | PTGDR2L3MBTL1ALDH1A1 | |
| SCHEMBL9737130 | 0.71 | L3MBTL1 (0.48) | L3MBTL1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5114944-A | Anxiolytic and anticonvulsant agents; muscle relaxants | A. H. ROBINS COMPANY INCORPORATED (US) | 1992-05-19 | — | — | US | disclosed |