Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8792932 | 0.75 | CA2 (0.35) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL5695216 | 0.74 | CA2 (0.38) | CA2MAPK1GPR84FFAR1MAPT | |
| SCHEMBL2578866 | 0.73 | GPR84 (0.46) | CA2GPR84FFAR1MAPTLCK | |
| SCHEMBL9323907 | 0.72 | AKR1B1 (0.38) | TDP1GPR84FFAR1PPARD | |
| SCHEMBL8896852 | 0.71 | — | — | |
| SCHEMBL28176864 | 0.68 | CA2 (0.43) | TDP1CA2MAPK1SLC1A2SLC1A1 | |
| SCHEMBL14691652 | 0.67 | TERT (0.44) | CHRM1TDP1MAPTPPARD | |
| SCHEMBL9850138 | 0.67 | GPR84 (0.38) | CA2MAPK1GPR84FFAR1MAPT | |
| SCHEMBL28659058 | 0.66 | AKR1B1 (0.36) | TDP1GPR84FFAR1PPARD | |
| SCHEMBL3042452 | 0.66 | SPHK1 (0.30) | — |
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-0409066-A2 | Optically active compound for liquid crystal and its use | MITSUBISHI RAYON COMPANY, LTD. (JP) | 1991-01-23 | — | — | EP | disclosed |