Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965800 | 0.84 | ALDH1A1 (0.58) | RAB9ATSHRNPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL14965599 | 0.84 | KDM4E (0.45) | RAB9ANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL14965322 | 0.84 | KMT2A (0.45) | RAB9ANPC1ALDH1A1GAAKDM4E | |
| SCHEMBL14965561 | 0.83 | KDM4E (0.45) | RAB9ANPC1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL14965370 | 0.83 | ALDH1A1 (0.44) | RAB9ATSHRNPC1ALDH1A1KDM4E | |
| SCHEMBL14965324 | 0.82 | TSHR (0.49) | RAB9ATSHRNPC1ALDH1A1GAA | |
| SCHEMBL14966186 | 0.82 | ALDH1A1 (0.48) | RAB9ATSHRNPC1ALDH1A1NAMPT | |
| SCHEMBL14965813 | 0.82 | ALDH1A1 (0.53) | TSHRALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL14966138 | 0.82 | NAMPT (0.43) | ALDH1A1NAMPTKDM4ESMN1; SMN2LMNA | |
| SCHEMBL14965661 | 0.82 | KDM4E (0.51) | RAB9ATSHRNPC1ALDH1A1KDM4E |
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 |