Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965569 | 0.92 | ALDH1A1 (0.42) | ALDH1A1MAPTRAB9ASMN1; SMN2LMNA | |
| SCHEMBL14965922 | 0.92 | MAPT (0.46) | ALDH1A1MAPTRAB9ASMN1; SMN2LMNA | |
| SCHEMBL14965511 | 0.88 | LTA4H (0.40) | ALDH1A1MAPTSMN1; SMN2LMNAMAPK1 | |
| SCHEMBL14965626 | 0.88 | LTA4H (0.40) | ALDH1A1MAPTSMN1; SMN2LMNAMAPK1 | |
| SCHEMBL14965896 | 0.87 | SUCNR1 (0.40) | ALDH1A1MAPTLMNASLC2A1 | |
| SCHEMBL14966243 | 0.87 | TNIK (0.45) | ALDH1A1MAPTLMNA | |
| SCHEMBL14969471 | 0.87 | KDM4E (0.41) | ALDH1A1MAPTSMN1; SMN2LMNA | |
| SCHEMBL14965684 | 0.85 | CHKA (0.45) | ALDH1A1SMN1; SMN2LMNATSHRMAPK1 | |
| SCHEMBL14966241 | 0.85 | ALDH1A1 (0.42) | ALDH1A1MAPTRAB9ASMN1; SMN2LMNA | |
| SCHEMBL14965635 | 0.84 | ALDH1A1 (0.42) | ALDH1A1MAPTRAB9ASMN1; SMN2LMNA |
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 1 patent. 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 | disclosed |