Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 2/20 | 0.53 |
| ▸ | SLC6A7 | Q99884 | 2/20 | 0.52 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965598 | 0.88 | NAAA (0.49) | NAAASLC6A7MGLLALDH1A1HPGD | |
| SCHEMBL14966218 | 0.83 | KMT2A (0.52) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL14966196 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDMAPTLMNANPC1 | |
| SCHEMBL14965706 | 0.81 | MEN1 (0.45) | NAAASLC6A7ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL14966119 | 0.81 | KMT2A (0.52) | ALDH1A1SMN1; SMN2MAPTLMNANPC1 | |
| SCHEMBL14965651 | 0.81 | HPGD (0.43) | ALDH1A1HPGDMAPTLMNAKMT2A | |
| SCHEMBL14966075 | 0.78 | KDM4E (0.46) | ALDH1A1SMN1; SMN2LMNAKMT2ANPSR1 | |
| SCHEMBL14965793 | 0.77 | HPGD (0.53) | ALDH1A1HPGDSMN1; SMN2MAPTLMNA | |
| SCHEMBL14965888 | 0.77 | PIK3CA (0.43) | ALDH1A1SMN1; SMN2MAPTLMNANPC1 | |
| SCHEMBL14966002 | 0.76 | HPGD (0.54) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A |
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 3 patents. 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 | claimed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |