Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP4 | P49662 | 1/20 | 0.36 |
| ▸ | CASP5 | P51878 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965682 | 0.85 | HTR7 (0.44) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14965773 | 0.84 | L3MBTL1 (0.46) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14965999 | 0.83 | ALDH1A1 (0.43) | POLBKDM4EALDH1A1LMNAFAAH | |
| SCHEMBL14965974 | 0.82 | FAAH (0.41) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14965699 | 0.81 | SMN1; SMN2 (0.43) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14971108 | 0.81 | ALDH1A1 (0.44) | KDM4EALDH1A1LMNAFAAHRAB9A | |
| SCHEMBL14965813 | 0.81 | ALDH1A1 (0.53) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14965655 | 0.80 | PDE4B (0.36) | MEN1KMT2APOLBALDH1A1CASP1 | |
| SCHEMBL14965939 | 0.80 | PDE9A (0.39) | MEN1KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL14966128 | 0.79 | ALDH1A1 (0.38) | ALDH1A1LMNAL3MBTL1 |
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 |