Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.78 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.78 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.78 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.78 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.62 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
| ▸ | SLC10A2 | Q12908 | 3/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.61 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL1147290 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL16241720 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL29459591 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL1492131 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL1654286 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL16252975 | 1.00 | GPBAR1 (0.78) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL16057839 | 0.93 | GPBAR1 (0.74) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL18424160 | 0.93 | GPBAR1 (0.74) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL759713 | 0.91 | GPBAR1 (0.71) | GPBAR1CYP3A4NR1H4PDE3ALMNA | |
| SCHEMBL4431263 | 0.90 | GPBAR1 (0.70) | GPBAR1CYP3A4NR1H4PDE3ALMNA |
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-2758060-B1 | ROR GAMMA MODULATORS FOR TREATING DIABETES II COMPLICATIONS | ETH Zürich (CH) | 2017-11-29 | — | — | EP | disclosed |