Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MMP12 | P39900 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30387201 | 0.85 | NPC1 (0.36) | IMPDH2IMPDH1ALDH1A1TSHRKDM4E | |
| SCHEMBL30043257 | 0.78 | MMP12 (0.53) | ALDH1A1TSHRKDM4EGAAHSD17B10 | |
| SCHEMBL235690 | 0.78 | MMP12 (0.53) | ALDH1A1TSHRKDM4EGAAHSD17B10 | |
| SCHEMBL10964913 | 0.78 | IMPDH2 (0.42) | IMPDH2IMPDH1ALDH1A1TSHRKDM4E | |
| SCHEMBL19627183 | 0.75 | IMPDH2 (0.47) | IMPDH2IMPDH1ALDH1A1KDM4EGAA | |
| SCHEMBL6569375 | 0.74 | TSHR (0.36) | ALDH1A1TSHRMMP12PDE3BPDE3A | |
| SCHEMBL8005199 | 0.73 | CYP3A4 (0.44) | ALDH1A1KDM4EGAAHPGDHSD17B10 | |
| SCHEMBL8525889 | 0.73 | ALDH1A1 (0.47) | ALDH1A1TSHRKDM4EGAAHPGD | |
| SCHEMBL6101436 | 0.71 | GRIN2D (0.40) | ALDH1A1KDM4EGRIN2DGRIN3BGRIN1 | |
| SCHEMBL2953764 | 0.70 | MMP12 (0.64) | ALDH1A1MMP12HTTPDE3BPDE3A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1405851-A1 | Method for producing seven-membered diether compounds and intermediates thereof | Takasago International Corporation (JP) | 2004-04-07 | — | — | EP | disclosed |