Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 8/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KCNA5 | P22460 | 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 | |
|---|---|---|---|---|
| SCHEMBL2411604 | 0.95 | PTGDR2 (0.35) | PTGDR2PTGER2ALDH1A1GAATSHR | |
| SCHEMBL4792901 | 0.88 | PTGDR2 (0.34) | PTGDR2PTGER2ALDH1A1HDAC3HDAC1 | |
| SCHEMBL1156756 | 0.87 | PTGER2 (0.38) | PTGDR2PTGER2ALDH1A1HDAC1TSHR | |
| SCHEMBL1278112 | 0.86 | PTGER2 (0.36) | PTGDR2PTGER2ALDH1A1HDAC3HDAC1 | |
| SCHEMBL4791526 | 0.85 | NAMPT (0.35) | PTGDR2PTGER2ALDH1A1TSHR | |
| Carbamic Acid SCHEMBL4791646 | 0.85 | PTGER2 (0.39) | PTGER2ALDH1A1HDAC1TSHRCNR2 | |
| SCHEMBL4422716 | 0.85 | PTGDR2 (0.33) | PTGDR2GAATSHRGFERSMN1; SMN2 | |
| SCHEMBL4791392 | 0.84 | PTGER2 (0.33) | PTGDR2PTGER2ALDH1A1KDM4E | |
| SCHEMBL4789906 | 0.84 | MMP9 (0.35) | PTGER2GAASMN1; SMN2 | |
| SCHEMBL1156219 | 0.84 | PTGDR2 (0.39) | PTGDR2PTGER2ALDH1A1GAATSHR |
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 |