Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR142 | Q7Z601 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4251963 | 0.80 | CYP3A4 (0.37) | GPR142CYP3A4 | |
| SCHEMBL4248621 | 0.78 | CYP3A4 (0.52) | CYP3A4 | |
| SCHEMBL4247398 | 0.77 | CYP3A4 (0.48) | CYP3A4 | |
| SCHEMBL4396378 | 0.76 | NR1I2 (0.36) | CYP3A4 | |
| SCHEMBL893478 | 0.74 | CYP3A4 (0.48) | CYP3A4 | |
| SCHEMBL4395637 | 0.74 | UGT1A1 (0.42) | GPR142CYP3A4 | |
| SCHEMBL893541 | 0.73 | CYP3A4 (0.48) | CYP3A4 | |
| SCHEMBL4396376 | 0.73 | CYP3A4 (0.35) | GPR142CYP3A4 | |
| SCHEMBL4248639 | 0.73 | CYP3A4 (0.39) | GPR142CYP3A4 | |
| SCHEMBL4251216 | 0.73 | UGT1A1 (0.58) | CYP3A4 |
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-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 |