Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7731485 | 1.00 | ALDH1A1 (0.40) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7731499 | 1.00 | ALDH1A1 (0.40) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7733221 | 0.97 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7733214 | 0.97 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7733226 | 0.94 | ALDH1A1 (0.34) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7733220 | 0.94 | ALDH1A1 (0.34) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7733213 | 0.94 | ALDH1A1 (0.34) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7732551 | 0.93 | MAPT (0.34) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7732547 | 0.93 | MAPT (0.34) | ALDH1A1LMNAMAPTCYP2C9MEN1 | |
| SCHEMBL7732540 | 0.93 | MAPT (0.34) | 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 |