Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7081567 | 0.77 | — | — | |
| SCHEMBL23855001 | 0.72 | GRM2 (0.32) | CYP1A2CYP2C19 | |
| SCHEMBL28859979 | 0.69 | CYP1A2 (0.36) | CYP1A2CYP2C19 | |
| SCHEMBL4024099 | 0.69 | CYP1A2 (0.34) | CYP1A2 | |
| SCHEMBL988593 | 0.69 | CYP1A2 (0.38) | CYP1A2CYP2C19 | |
| SCHEMBL2277287 | 0.67 | FFAR3 (0.39) | CYP1A2PTPN1CYP2C19 | |
| SCHEMBL2277283 | 0.67 | FFAR3 (0.39) | CYP1A2PTPN1CYP2C19 | |
| SCHEMBL7439240 | 0.67 | CYP1A2 (0.37) | CYP1A2CYP2C19 | |
| SCHEMBL2277288 | 0.67 | FFAR3 (0.39) | CYP1A2PTPN1CYP2C19 | |
| SCHEMBL17821216 | 0.66 | CYP1A2 (0.32) | CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0398941-A4 | DRY POWDER DIAGNOSTIC REAGENT AND APPLICATIONS THEREOF | — | 1991-04-10 | — | — | EP | disclosed |
| EP-0398941-A1 | DRY POWDER DIAGNOSTIC REAGENT AND APPLICATIONS THEREOF | BOEHRINGER MANNHEIM CORPORATION (US) | 1990-11-28 | — | — | EP | disclosed |
| WO-1989006284-A1 | DRY POWDER DIAGNOSTIC REAGENT AND APPLICATIONS THEREOF | BOEHRINGER MANNHEIM CORPORATION (US) | 1989-07-13 | — | — | WO | disclosed |