Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 4/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.34 |
| ▸ | ADAMTS5 | Q9UNA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL1709369 | 0.89 | HSD11B1 (0.41) | HSD11B1MGLLCYP3A4HTTRECQL | |
| SCHEMBL10033110 | 0.77 | MAPK1 (0.43) | CYP3A4SMN1; SMN2SLC6A2KDM4EALDH1A1 | |
| SCHEMBL1709405 | 0.77 | TACR1 (0.38) | HSD11B1MGLLMCHR1TACR1 | |
| SCHEMBL10032832 | 0.76 | TACR1 (0.36) | HSD11B1MGLLMCHR1TACR1 | |
| SCHEMBL10032831 | 0.76 | TACR1 (0.36) | HSD11B1MGLLMCHR1TACR1 | |
| SCHEMBL1709509 | 0.76 | DPEP1 (0.36) | HSD11B1MGLLMCHR1TACR1 | |
| SCHEMBL1709462 | 0.76 | DPEP1 (0.36) | HSD11B1MGLLMCHR1TACR1 | |
| SCHEMBL1709490 | 0.75 | ALDH1A1 (0.38) | HSD11B1MGLLMCHR1KDM4EALDH1A1 | |
| SCHEMBL1709474 | 0.75 | ALDH1A1 (0.38) | HSD11B1MGLLMCHR1KDM4EALDH1A1 | |
| SCHEMBL10032998 | 0.72 | HTR2C (0.40) | HSD11B1MGLLSMN1; SMN2MCHR1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |