Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | CACNA1G | O43497 | 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 | |
|---|---|---|---|---|
| SCHEMBL7735487 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7735481 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7729160 | 0.99 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7729163 | 0.99 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7735340 | 0.95 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7735345 | 0.95 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7735348 | 0.95 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7731692 | 0.93 | HTR2C (0.40) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7731697 | 0.93 | HTR2C (0.40) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7731690 | 0.93 | HTR2C (0.40) | ALDH1A1LMNAMAPTCYP2C9MEN1 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |