Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2709173 | 0.74 | KCNH2 (0.31) | KCNH2CYP1A2GRM5 | |
| SCHEMBL8605940 | 0.74 | KCNH2 (0.35) | KCNH2CYP1A2GRM5 | |
| SCHEMBL5814497 | 0.74 | FFAR1 (0.33) | KCNH2CYP1A2GRM5 | |
| SCHEMBL2106124 | 0.73 | KCNH2 (0.39) | KCNH2CYP1A2GRM5 | |
| SCHEMBL8607313 | 0.70 | — | — | |
| SCHEMBL11672723 | 0.70 | — | — | |
| SCHEMBL25175734 | 0.70 | CYP1A2 (0.34) | KCNH2CYP1A2 | |
| SCHEMBL27437243 | 0.70 | — | — | |
| SCHEMBL21252652 | 0.69 | — | — | |
| SCHEMBL10735656 | 0.69 | HCAR2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1077927-A1 | NOVEL SUBSTITUTED CYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ADIR ET COMPAGNIE (FR) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999058495-A1 | NOVEL SUBSTITUTED CYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ADIR ET COMPAGNIE (FR) | 1999-11-18 | — | — | WO | disclosed |