Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | JMJD6 | Q6NYC1 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL14966317 | 0.89 | LOXL2 (0.42) | ALDH1A1SMN1; SMN2MEN1KMT2AHDAC1 | |
| SCHEMBL14965922 | 0.89 | MAPT (0.46) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14966012 | 0.88 | KCNJ1 (0.42) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14965569 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14966241 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14971086 | 0.84 | ALDH1A1 (0.41) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14971109 | 0.84 | TP53 (0.40) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14966056 | 0.83 | ALDH1A1 (0.41) | ALDH1A1KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14965508 | 0.82 | CAMKK2 (0.37) | KCNJ1KCNH2MAPTSMN1; SMN2 | |
| SCHEMBL14966162 | 0.82 | CHRM1 (0.36) | KCNH2SMN1; SMN2LMNASTAT3HDAC1 |
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 | claimed |