Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 13/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6457720 | 1.00 | KIF11 (0.42) | KIF11KDM1ACYP11B1CYP11B2PTGS2 | |
| SCHEMBL6454471 | 0.91 | KIF11 (0.40) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6454469 | 0.91 | KIF11 (0.40) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6457054 | 0.89 | KIF11 (0.39) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6458120 | 0.89 | KDM1A (0.39) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6458116 | 0.89 | KDM1A (0.39) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6457058 | 0.89 | KIF11 (0.39) | KIF11KDM1ACYP11B1CYP11B2 | |
| SCHEMBL6456231 | 0.88 | DGAT1 (0.33) | — | |
| SCHEMBL6456230 | 0.88 | DGAT1 (0.33) | — | |
| SCHEMBL6453545 | 0.88 | KIF11 (0.38) | KIF11KDM1ACYP11B1CYP11B2 |
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 |