Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | CHKA | P35790 | 1/20 | 0.47 |
| ▸ | LSS | P48449 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GALR3 | O60755 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966002 | 0.97 | HPGD (0.54) | HPGDCHKAPKMNPSR1CDK1 | |
| SCHEMBL14965948 | 0.94 | HPGD (0.50) | HPGDCHKALSSPKMNPSR1 | |
| SCHEMBL14965690 | 0.92 | HRH3 (0.54) | HPGDCHKALSSPKMNPSR1 | |
| SCHEMBL14965793 | 0.91 | HPGD (0.53) | HPGDPKMNPSR1SMN1; SMN2KDM4E | |
| SCHEMBL14965840 | 0.89 | HRH3 (0.57) | HPGDCHKAPKMNPSR1SMN1; SMN2 | |
| SCHEMBL14965368 | 0.89 | KCNJ1 (0.40) | LSSPKMNPSR1SMN1; SMN2KDM4E | |
| SCHEMBL14971065 | 0.88 | SLC2A1 (0.41) | PKMNPSR1SMN1; SMN2HRH3ALDH1A1 | |
| SCHEMBL14965662 | 0.87 | ALDH1A1 (0.38) | HPGDSMN1; SMN2KDM4EALDH1A1HTT | |
| SCHEMBL14965407 | 0.86 | KCNJ1 (0.42) | PKMNPSR1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL14965941 | 0.85 | HRH3 (0.46) | HPGDLSSPKMNPSR1SMN1; SMN2 |
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 2 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 |