Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 2/20 | 0.40 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL27636008 | 0.79 | STS (0.37) | STSDPP4 | |
| SCHEMBL28007547 | 0.79 | STS (0.37) | STSDPP4 | |
| SCHEMBL30464845 | 0.79 | STS (0.37) | STSDPP4 | |
| SCHEMBL27484924 | 0.76 | STS (0.37) | STSDPP4 | |
| SCHEMBL28854151 | 0.75 | CBFB (0.33) | STS | |
| SCHEMBL27682658 | 0.73 | HTR2C (0.49) | — | |
| SCHEMBL26245638 | 0.70 | S1PR1 (0.40) | — | |
| SCHEMBL27955233 | 0.70 | ESR2 (0.38) | STS | |
| SCHEMBL28120174 | 0.69 | PTGDR2 (0.49) | — | |
| SCHEMBL28099500 | 0.68 | ALDH1A1 (0.31) | STS |
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 |
|---|---|---|---|---|---|---|---|
| CN-104211639-A | Alkynyl heterocyclic compounds and application thereof | SHANGHAI INST MATERIA MEDICA | 2014-12-17 | — | — | CN | disclosed |