Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 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 | |
|---|---|---|---|---|
| SCHEMBL14965703 | 0.85 | SMN1; SMN2 (0.49) | MAPK1POLBALDH1A1MAPTLMNA | |
| SCHEMBL14966106 | 0.83 | SMN1; SMN2 (0.46) | MAPK1POLBALDH1A1MAPTLMNA | |
| SCHEMBL14966132 | 0.80 | DRD4 (0.44) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL14965623 | 0.76 | CYP2A13 (0.48) | KDM4EPOLBMEN1KMT2AALDH1A1 | |
| SCHEMBL14965611 | 0.76 | TSHR (0.61) | KDM4EPOLBMEN1KMT2AALDH1A1 | |
| SCHEMBL14965773 | 0.75 | L3MBTL1 (0.46) | KDM4EPOLBMEN1KMT2AALDH1A1 | |
| SCHEMBL14966015 | 0.75 | CHRM1 (0.44) | POLBMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL14965842 | 0.75 | CHRM1 (0.59) | ALDH1A1MAPTLMNATSHRSMN1; SMN2 | |
| SCHEMBL14965682 | 0.75 | HTR7 (0.44) | KDM4EPOLBMEN1KMT2AALDH1A1 | |
| SCHEMBL14966045 | 0.74 | TSHR (0.50) | MEN1KMT2AALDH1A1GAALMNA |
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 |