Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.43 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9664122 | 0.93 | RARB (0.47) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL18503378 | 0.93 | BACE1 (0.46) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL9664907 | 0.91 | RARB (0.45) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL14752903 | 0.91 | RARB (0.48) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL19820863 | 0.91 | BACE1 (0.45) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL19820862 | 0.91 | PDE3B (0.46) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL14752904 | 0.91 | BACE1 (0.49) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL19820866 | 0.91 | RARB (0.46) | BACE1CYP1A2CYP2A6TAAR1RARB | |
| SCHEMBL9664958 | 0.91 | RARB (0.54) | BACE1RARBPDE3BPDE3AS1PR1 | |
| SCHEMBL19820864 | 0.89 | PDE3B (0.45) | BACE1CYP1A2CYP2A6TAAR1RARB |
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 |
|---|---|---|---|---|---|---|---|
| US-20170045765-A1 | LCD DEVICE | DIC CORPORATION (JP) | 2017-02-16 | — | — | US | disclosed |