Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1D1 | P20393 | 8/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 8/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 7/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | MGMT | P16455 | 1/20 | 0.34 |
| ▸ | KCNJ5 | P48544 | 3/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965901 | 0.90 | MITF (0.37) | MITFALDH1A1LMNA | |
| SCHEMBL14965850 | 0.84 | MITF (0.35) | KCNA5MITFMGMTMAPTLMNA | |
| SCHEMBL14969412 | 0.84 | NR1D1 (0.36) | NR1D1NR1H3MITFALDH1A1MAPT | |
| SCHEMBL14965539 | 0.84 | NR1H3 (0.39) | NR1D1NR1H3MITFALDH1A1MAPT | |
| SCHEMBL14965670 | 0.83 | MITF (0.35) | MITFALDH1A1LMNA | |
| SCHEMBL14969684 | 0.83 | NR1D1 (0.36) | NR1D1KCNA5MITFKCNJ5KCNJ3 | |
| SCHEMBL14966156 | 0.83 | KCNH2 (0.37) | — | |
| SCHEMBL14965947 | 0.83 | MEP1B (0.37) | NR1D1NR1H3MITFLMNA | |
| SCHEMBL14971104 | 0.82 | NR1D1 (0.37) | NR1D1NR1H3KCNA5MITFKCNJ5 | |
| SCHEMBL14966100 | 0.82 | KCNH2 (0.40) | MITFALDH1A1 |
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-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |