Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.67 |
| ▸ | MAOA | P21397 | 1/20 | 0.67 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.61 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.61 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.57 |
| ▸ | DPP4 | P27487 | 2/20 | 0.54 |
| ▸ | KRAS | P01116 | 1/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14305992 | 0.88 | MAOB (0.67) | MAOBMAOAGABRA3GABRA2GABRB2 | |
| SCHEMBL20244436 | 0.86 | MAOA (0.50) | MAOBMAOAGABRA3GABRA2GABRB2 | |
| SCHEMBL4139154 | 0.84 | GABRA3 (0.78) | MAOBGABRA3GABRA2GABRB2ALDH1A1 | |
| SCHEMBL28339980 | 0.84 | GABRA3 (0.78) | MAOBGABRA3GABRA2GABRB2ALDH1A1 | |
| SCHEMBL29083859 | 0.83 | TYR (0.65) | MAOBMAOAALDH1A1MAPTNPC1 | |
| SCHEMBL27631290 | 0.83 | TYR (0.65) | MAOBMAOAALDH1A1MAPTNPC1 | |
| SCHEMBL1603828 | 0.82 | CHRNA7 (0.75) | GABRA3GABRA2GABRB2ALDH1A1MAPT | |
| SCHEMBL1603827 | 0.82 | CHRNA7 (0.75) | GABRA3GABRA2GABRB2ALDH1A1MAPT | |
| SCHEMBL31326032 | 0.81 | MAOB (1.00) | MAOBMAOAALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL10658782 | 0.81 | MAOB (1.00) | MAOBMAOAALDH1A1MAPTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3333153-A1 | NUCLEAR RECEPTOR MODULATORS AND THEIR USE FOR THE TREATMENT AND PREVENTION OF CANCER | The U.S.A. as represented by the Secretary, Department of Health and Human Services (US) | 2018-06-13 | — | — | EP | disclosed |