Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.43 |
| ▸ | SMO | Q99835 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL14966188 | 0.92 | KDM4E (0.50) | DRD4TMEM97DRD2ALDH1A1MCHR1 | |
| SCHEMBL14965511 | 0.89 | LTA4H (0.40) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL14965626 | 0.89 | LTA4H (0.40) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL14965902 | 0.89 | KDM4E (0.53) | DRD4TMEM97ALDH1A1MCHR1KDM4E | |
| SCHEMBL14965896 | 0.88 | SUCNR1 (0.40) | ALDH1A1MCHR1KMT2AMEN1 | |
| SCHEMBL14969471 | 0.88 | KDM4E (0.41) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL14965822 | 0.87 | FGFR1 (0.45) | DRD4MCHR1KDM4ECCR3 | |
| SCHEMBL14966181 | 0.86 | KDM4E (0.56) | DRD4TMEM97ALDH1A1MCHR1KDM4E | |
| SCHEMBL14966243 | 0.85 | TNIK (0.45) | DRD2ALDH1A1KMT2AMEN1ACHE | |
| SCHEMBL14965650 | 0.84 | CNR1 (0.42) | DRD4MCHR1KDM4EKMT2ANPC1 |
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 |