Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR142 | Q7Z601 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL4244088 | 1.00 | GPR142 (0.38) | GPR142CYP3A4SLC6A3SLC6A2 | |
| SCHEMBL4251442 | 0.89 | CYP3A4 (0.38) | GPR142CYP3A4 | |
| SCHEMBL4251437 | 0.89 | CYP3A4 (0.38) | GPR142CYP3A4 | |
| SCHEMBL4566333 | 0.89 | CYP3A4 (0.38) | GPR142CYP3A4 | |
| SCHEMBL4251973 | 0.86 | ACACB (0.42) | GPR142CYP3A4 | |
| SCHEMBL4251176 | 0.86 | ACACB (0.42) | GPR142CYP3A4 | |
| SCHEMBL4251971 | 0.86 | ACACB (0.42) | GPR142CYP3A4 | |
| SCHEMBL4255599 | 0.84 | GPR142 (0.40) | GPR142CYP3A4 | |
| SCHEMBL4399069 | 0.84 | GPR142 (0.40) | GPR142CYP3A4 | |
| SCHEMBL4247484 | 0.82 | CYP3A4 (0.38) | GPR142CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2081917-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | Abbott Laboratories (US) | 2009-07-29 | — | — | EP | claimed |
| WO-2008027932-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-03-06 | — | — | WO | claimed |
| EP-2081917-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | Abbott Laboratories (US) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008027932-A2 | CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-03-06 | — | — | WO | disclosed |