Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 4/20 | 0.45 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27719211 | 0.80 | APP (0.57) | HSD17B1HSD17B2ESR2TLR8BACE1 | |
| SCHEMBL11499315 | 0.80 | HSD17B1 (0.46) | HSD17B1HSD17B2PDE4BESR2TLR8 | |
| SCHEMBL27558291 | 0.79 | BACE1 (0.56) | PDE4BESR2PDE4APDE4CPDE4D | |
| SCHEMBL27493715 | 0.79 | ESR2 (0.48) | PDE4BESR2PDE4APDE4CPDE4D | |
| SCHEMBL21409958 | 0.75 | HSD17B1 (0.59) | HSD17B1HSD17B2ESR2TLR8BACE1 | |
| SCHEMBL4192887 | 0.74 | ESR1 (0.46) | PDE4BESR2ESR1ALDH1A1 | |
| SCHEMBL171134 | 0.74 | HSD17B1 (0.74) | HSD17B1HSD17B2ESR2CYP3A4CYP2D6 | |
| SCHEMBL7649543 | 0.73 | BACE1 (0.58) | PDE4BESR2PDE4APDE4CPDE4D | |
| SCHEMBL9469342 | 0.73 | PDE4B (0.50) | PDE4BESR2PDE4APDE4CPDE4D | |
| SCHEMBL27849764 | 0.73 | HSD17B1 (0.53) | HSD17B1HSD17B2ESR2TLR8BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1279692-B1 | OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER | MITSUI CHEMICALS INC (JP) | 2009-02-18 | — | — | EP | disclosed |
| EP-1279692-A1 | OPTICAL PARTS AND SULFUR-CONTAINING POLY(THIO)ESTER (CO)POLYMER | Mitsui Chemicals, Inc. (JP) | 2003-01-29 | — | — | EP | disclosed |