Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1D1 | P20393 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL14965763 | 0.91 | MITF (0.34) | MITFKCNH2NPC1RAB9ASOS1 | |
| SCHEMBL14966100 | 0.91 | KCNH2 (0.40) | MITFKCNH2SOS1OPRM1ALDH1A1 | |
| SCHEMBL14965901 | 0.90 | MITF (0.37) | MITFSOS1ALDH1A1POLB | |
| SCHEMBL14969684 | 0.89 | NR1D1 (0.36) | NR1D1MITFMAOASOS1ALDH1A1 | |
| SCHEMBL14969675 | 0.87 | ALDH1A1 (0.33) | MITFNR1H3NPC1RAB9AMAPT | |
| SCHEMBL14965734 | 0.84 | NR1D1 (0.38) | NR1D1MITFNR1H3MAPTALDH1A1 | |
| SCHEMBL14966156 | 0.83 | KCNH2 (0.37) | KCNH2 | |
| SCHEMBL14965947 | 0.82 | MEP1B (0.37) | NR1D1MITFNR1H3KCNH2 | |
| SCHEMBL14971141 | 0.82 | NR1D1 (0.37) | NR1D1MITFNR1H3MAOAMAOB | |
| SCHEMBL14965850 | 0.82 | MITF (0.35) | MITFMAPTSMN1; SMN2POLB |
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 |