Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | OXTR | P30559 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2410116 | 0.91 | — | — | |
| SCHEMBL2411402 | 0.90 | DHODH (0.30) | — | |
| SCHEMBL5008551 | 0.88 | NFE2L2 (0.34) | NFE2L2MMP2MMP9MMP8MMP13 | |
| SCHEMBL2410517 | 0.88 | DHODH (0.31) | — | |
| SCHEMBL4570003 | 0.87 | TAS2R14 (0.35) | MMP2MMP9MMP8MMP13OXTR | |
| SCHEMBL2411542 | 0.86 | MET (0.41) | NFE2L2MMP2MMP9MMP8MMP13 | |
| SCHEMBL1831288 | 0.86 | NFE2L2 (0.34) | NFE2L2MMP2MMP9MMP8MMP13 | |
| SCHEMBL1835214 | 0.86 | MMP2 (0.35) | NFE2L2MMP2MMP9MMP8MMP13 | |
| SCHEMBL2414690 | 0.85 | HTR6 (0.32) | — | |
| SCHEMBL2408854 | 0.85 | NFE2L2 (0.34) | NFE2L2MMP2MMP9MMP8MMP13 |
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-2364979-A1 | Pyrrole compounds | Takeda Pharmaceutical Company Limited (JP) | 2011-09-14 | — | — | EP | disclosed |
| EP-2114917-A2 | PYRROLE COMPOUNDS | Takeda Pharmaceutical Company Limited (JP) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008108380-A2 | PYRROLE COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-12 | — | — | WO | disclosed |