Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | JAK1 | P23458 | 10/20 | 0.35 |
| ▸ | JAK2 | O60674 | 9/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28022831 | 1.00 | MEN1 (0.39) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL28022336 | 0.78 | GPR119 (0.36) | MEN1KMT2AALDH1A1MAPTADRA2A | |
| SCHEMBL28288979 | 0.69 | HRH3 (0.36) | CTSKCASP3 | |
| SCHEMBL8006059 | 0.67 | GRM4 (0.39) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL8016075 | 0.67 | DPP4 (0.38) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL8016077 | 0.67 | DPP4 (0.38) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL8006057 | 0.67 | GRM4 (0.39) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL8016078 | 0.67 | DPP4 (0.38) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL8006061 | 0.67 | GRM4 (0.39) | MEN1KMT2AALDH1A1MAPTCTSK | |
| SCHEMBL12994226 | 0.65 | CTSK (0.34) | MEN1KMT2AALDH1A1MAPTCTSK |
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 |
|---|---|---|---|---|---|---|---|
| CN-104703980-A | Orexin receptor antagonists which are [ortho bi (hetero )aryl]-[2-(meta bi (hetero )aryl)-pyrrolidin-1-yl]-methanone derivatives | ACTELION PHARMACEUTICALS LTD | 2015-06-10 | — | — | CN | disclosed |