Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.56 |
| ▸ | PPARG | P37231 | 4/20 | 0.56 |
| ▸ | PPARD | Q03181 | 2/20 | 0.56 |
| ▸ | PPARA | Q07869 | 1/20 | 0.56 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.50 |
| ▸ | CBS | P35520 | 1/20 | 0.49 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.49 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.49 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7697263 | 0.88 | L3MBTL1 (0.50) | NR1H4PPARGPPARDPPARANHERF1 | |
| SCHEMBL7690902 | 0.82 | NR1H4 (0.47) | NR1H4PPARGPPARDPPARAMEN1 | |
| SCHEMBL7696457 | 0.79 | AKR1C3 (0.51) | MEN1KMT2AALDH1A1 | |
| SCHEMBL7695539 | 0.78 | PPARG (0.54) | NR1H4PPARGMEN1KMT2ANPC1 | |
| SCHEMBL1811041 | 0.76 | KCNK3 (0.81) | MEN1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29204765 | 0.76 | HPSE (0.63) | NR1H4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL30488668 | 0.76 | KMT2A (0.62) | NR1H4MEN1KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL2105080 | 0.76 | MEN1 (0.64) | NR1H4PPARGPPARDPPARANHERF1 | |
| SCHEMBL9164792 | 0.75 | MEN1 (0.66) | NR1H4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL9161426 | 0.75 | MEN1 (0.66) | NR1H4MEN1KMT2ANPC1RAB9A |
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-2002053544-A1 | PHARMACEUTICAL USES AND SYNTHESIS OF NICOTINANILIDE-N-OXIDES | DARWIN DISCOVERY LTD. (GB) | 2002-07-11 | — | — | WO | disclosed |