Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 4/20 | 0.33 |
| ▸ | OXTR | P30559 | 2/20 | 0.33 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.33 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.33 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 6/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR1B | P28222 | 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 | |
|---|---|---|---|---|
| SCHEMBL4570003 | 0.85 | TAS2R14 (0.35) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL2409083 | 0.85 | NAMPT (0.38) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL2409079 | 0.84 | TAS2R14 (0.37) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL4570000 | 0.81 | MMP2 (0.36) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL4570001 | 0.81 | OXTR (0.34) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL1580223 | 0.81 | EIF2AK3 (0.37) | NAMPTOXTRAVPR2AVPR1AEIF2AK3 | |
| Fumaric Acid SCHEMBL2408204 | 0.80 | NAMPT (0.37) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| Fumaric Acid SCHEMBL2408214 | 0.80 | NAMPT (0.37) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL17965497 | 0.80 | NAMPT (0.36) | TAS2R14NAMPTOXTRAVPR2AVPR1A | |
| SCHEMBL1833794 | 0.76 | PTGDR2 (0.34) | MMP2MMP9MMP8MMP13PTGDR2 |
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-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 |