Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL14971108 | 0.93 | ALDH1A1 (0.44) | L3MBTL1GAARAB9AALDH1A1MAPT | |
| SCHEMBL14971091 | 0.91 | DRD2 (0.44) | L3MBTL1GAARAB9AALDH1A1MAPT | |
| SCHEMBL14965999 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNASMN1; SMN2KCNJ1 | |
| SCHEMBL14965590 | 0.88 | CHRNB2 (0.45) | ALDH1A1TDP1POLBKDM4E | |
| SCHEMBL14965407 | 0.88 | KCNJ1 (0.42) | L3MBTL1RAB9AALDH1A1MAPTMEN1 | |
| SCHEMBL14965699 | 0.87 | SMN1; SMN2 (0.43) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL14965800 | 0.87 | ALDH1A1 (0.58) | RAB9AALDH1A1MCHR1MEN1KMT2A | |
| SCHEMBL14965775 | 0.87 | L3MBTL1 (0.41) | L3MBTL1GAARAB9AALDH1A1MAPT | |
| SCHEMBL14965837 | 0.86 | HIF1A (0.44) | L3MBTL1ALDH1A1MAPTLMNASMN1; SMN2 | |
| SCHEMBL14965703 | 0.86 | SMN1; SMN2 (0.49) | ALDH1A1MAPTLMNASMN1; SMN2KCNJ1 |
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 |