Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6459691 | 1.00 | PTGS2 (0.36) | PTGS2PTGS1TP53MAPTPOLB | |
| SCHEMBL6464851 | 0.96 | PTGS1 (0.35) | PTGS2PTGS1TP53MAPTPOLB | |
| SCHEMBL6464848 | 0.96 | PTGS1 (0.35) | PTGS2PTGS1TP53MAPTPOLB | |
| SCHEMBL14526179 | 0.96 | CYP2C9 (0.37) | TP53MAPTPOLBCYP2C9MEN1 | |
| SCHEMBL6459106 | 0.95 | GAA (0.37) | PTGS2PTGS1MAPTCYP2C9SPHK1 | |
| SCHEMBL6458712 | 0.95 | GAA (0.37) | PTGS2PTGS1MAPTCYP2C9SPHK1 | |
| SCHEMBL6459111 | 0.95 | GAA (0.37) | PTGS2PTGS1MAPTCYP2C9SPHK1 | |
| SCHEMBL6458704 | 0.95 | GAA (0.37) | PTGS2PTGS1MAPTCYP2C9SPHK1 | |
| SCHEMBL14526180 | 0.92 | SPHK1 (0.37) | MAPTCYP2C9MEN1MAPK1KMT2A | |
| SCHEMBL6454892 | 0.92 | CYP2C9 (0.42) | PTGS2PTGS1MAPTCYP2C9MEN1 |
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 |