Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965541 | 0.90 | CD274 (0.39) | CD274MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL14966106 | 0.89 | SMN1; SMN2 (0.46) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14966198 | 0.86 | KCNJ1 (0.40) | CD274MAPTSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL14965703 | 0.86 | SMN1; SMN2 (0.49) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14965620 | 0.85 | ALDH1A1 (0.38) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14971108 | 0.85 | ALDH1A1 (0.44) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14966132 | 0.84 | DRD4 (0.44) | MAPTSMN1; SMN2ALDH1A1LMNAHTT | |
| SCHEMBL14965513 | 0.84 | LSS (0.46) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14965907 | 0.82 | TBK1 (0.37) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 | |
| SCHEMBL14965550 | 0.81 | SLC2A1 (0.39) | MAPTSMN1; SMN2ALDH1A1LMNAKCNJ1 |
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 |