Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966204 | 0.97 | SLC2A1 (0.42) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL14965322 | 0.91 | KMT2A (0.45) | ALDH1A1LMNAKMT2AMEN1MAPT | |
| SCHEMBL14965896 | 0.89 | SUCNR1 (0.40) | ALDH1A1LMNAKMT2AMEN1MAPT | |
| SCHEMBL14965800 | 0.88 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1TSHRHDAC1 | |
| SCHEMBL14965796 | 0.88 | MCHR1 (0.45) | ALDH1A1LMNAKMT2AMEN1MAPT | |
| SCHEMBL14969456 | 0.88 | POLB (0.43) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL14966186 | 0.88 | ALDH1A1 (0.48) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL14965611 | 0.87 | TSHR (0.61) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL14971087 | 0.87 | KMT2A (0.41) | ALDH1A1LMNAKMT2AMEN1MAPT | |
| SCHEMBL14965407 | 0.86 | KCNJ1 (0.42) | ALDH1A1LMNAKMT2AMEN1MAPT |
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 |