Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDH1 | P40925 | 1/20 | 0.34 |
| ▸ | MDH2 | P40926 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6370175 | 0.88 | — | — | |
| SCHEMBL6105737 | 0.87 | SCN9A (0.30) | SCN9ACYP17A1CYP19A1 | |
| SCHEMBL6105532 | 0.86 | CYP17A1 (0.37) | CYP17A1CYP19A1 | |
| SCHEMBL678282 | 0.85 | PKM (0.33) | MDH1MDH2PKMHSD11B1DPP4 | |
| SCHEMBL6370671 | 0.85 | KMT2A (0.37) | PKMCYP17A1CYP19A1 | |
| SCHEMBL13115388 | 0.79 | PKM (0.37) | MDH1MDH2PKMHSD11B1DPP4 | |
| SCHEMBL6106466 | 0.77 | EPHX2 (0.30) | — | |
| SCHEMBL6370850 | 0.77 | EPHX2 (0.33) | — | |
| SCHEMBL1028437 | 0.77 | PKM (0.33) | MDH1MDH2PKMHSD11B1DPP4 | |
| SCHEMBL3680710 | 0.76 | CYP17A1 (0.32) | CYP17A1CYP19A1 |
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-20050142487-A1 | Polymerizable adamantane derivative, production process thereof and polymeric compound | DAICEL CHEMICAL INDUSTRIES, LTD. | 2005-06-30 | — | — | US | disclosed |