Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.35 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709471 | 0.96 | KDM4E (0.40) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL1709479 | 0.84 | SLC6A3 (0.36) | TDP1SLC6A2 | |
| SCHEMBL4549803 | 0.76 | TACR1 (0.41) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL1709392 | 0.74 | MAOA (0.44) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL3580847 | 0.74 | TACR1 (0.44) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL1709428 | 0.72 | CYP11B1 (0.43) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL8160590 | 0.72 | KDM4E (0.39) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL8152875 | 0.72 | KDM4E (0.39) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL14984450 | 0.72 | DGAT1 (0.47) | KDM4EALDH1A1TDP1POLBGAA | |
| SCHEMBL1709391 | 0.71 | SSTR3 (0.46) | POLB |
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 |