Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HTT | P42858 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL14965804 | 0.89 | KMT2A (0.41) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14965548 | 0.89 | CHRM1 (0.52) | CA1CA2CA7KMT2AMEN1 | |
| SCHEMBL14965565 | 0.88 | KMT2A (0.43) | CA1CA2CA7CA9LMNA | |
| SCHEMBL14965622 | 0.87 | CHRM1 (0.50) | KMT2AMEN1HTTUSP2 | |
| SCHEMBL14965611 | 0.86 | TSHR (0.61) | LMNAKMT2AMEN1TSHRALDH1A1 | |
| SCHEMBL14966219 | 0.86 | CA1 (0.48) | CA1CA2CA7CA9KMT2A | |
| SCHEMBL14965703 | 0.84 | SMN1; SMN2 (0.49) | LMNASMN1; SMN2TSHRALDH1A1HTT | |
| SCHEMBL14966113 | 0.83 | POLB (0.39) | KMT2ASMN1; SMN2MEN1ALDH1A1HTT | |
| SCHEMBL14965889 | 0.83 | ALDH1A1 (0.44) | KMT2ASMN1; SMN2MEN1TSHRALDH1A1 | |
| SCHEMBL14965929 | 0.82 | USP2 (0.39) | KMT2AMEN1ALDH1A1HTTPOLB |
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 |