Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 2/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL6463251 | 1.00 | NOTUM (0.32) | NOTUMPGRKDM1AMAOBPTPN11 | |
| SCHEMBL6458212 | 0.88 | PTGS2 (0.38) | PTGS2 | |
| SCHEMBL6458205 | 0.88 | PTGS2 (0.38) | PTGS2 | |
| SCHEMBL16381848 | 0.87 | ESR2 (0.37) | NOTUMPGRKDM1AMAOBCREBBP | |
| SCHEMBL6464722 | 0.87 | KDM1A (0.43) | KDM1APTGS2 | |
| SCHEMBL6464726 | 0.87 | KDM1A (0.43) | KDM1APTGS2 | |
| SCHEMBL6459690 | 0.86 | CNR1 (0.31) | — | |
| SCHEMBL6459684 | 0.86 | CNR1 (0.31) | — | |
| SCHEMBL6451295 | 0.86 | — | — | |
| SCHEMBL6452696 | 0.86 | ESR2 (0.36) | NOTUMPGRKDM1APTGS2HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |