Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FASN | P49327 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | APP | P05067 | 2/20 | 0.37 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | CHKA | P35790 | 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 | |
|---|---|---|---|---|
| SCHEMBL20209857 | 1.00 | FASN (0.38) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL13083558 | 0.94 | FASN (0.40) | FASNCYP3A4CYP2C9APPS1PR1 | |
| SCHEMBL20209858 | 0.91 | FASN (0.38) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL20202975 | 0.91 | RARB (0.39) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL9662806 | 0.91 | RARB (0.39) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL8990839 | 0.91 | FFAR4 (0.40) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL9664291 | 0.91 | FASN (0.38) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL20202979 | 0.91 | CYP2C9 (0.39) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL9664809 | 0.91 | CYP2C9 (0.39) | FASNCYP3A4CYP2C9APPRARB | |
| SCHEMBL16186516 | 0.90 | RARB (0.40) | FASNCYP3A4CYP2C9APPRARB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5093026-A | Liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-03-03 | — | — | US | disclosed |
| WO-1990008756-A1 | DIPHENYLETHANES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-09 | — | — | WO | disclosed |