Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 7/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19897916 | 1.00 | CD274 (0.39) | CD274HTR1BPDE5APDE4APDE4B | |
| SCHEMBL28893425 | 0.85 | L3MBTL1 (0.41) | HTR1BPDE5APDE4APDE4BPDE4C | |
| SCHEMBL18727936 | 0.85 | CD274 (0.46) | CD274PDE5APDE4APDE4BPDE4C | |
| SCHEMBL28960000 | 0.83 | HTR1B (0.46) | CD274HTR1BSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL30668196 | 0.83 | HTR1B (0.46) | CD274HTR1BSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL28959992 | 0.80 | HTR7 (0.49) | CD274SMN1; SMN2TDP1TP53ALDH1A1 | |
| SCHEMBL11097966 | 0.80 | CYP1A2 (0.47) | HTR1BPDE5APDE4APDE4BPDE4C | |
| SCHEMBL10681054 | 0.79 | HTR1B (0.45) | CD274HTR1BSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL20729422 | 0.78 | CD274 (0.37) | CD274HTR1BPDE5APDE4APDE4B | |
| SCHEMBL10677209 | 0.78 | TP53 (0.49) | PDE5APDE4APDE4BPDE4CPDE4D |
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-109863146-B | Biaryl compounds as immunomodulators | 百时美施贵宝公司 | 2023-02-28 | — | — | CN | disclosed |