Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2225047 | 0.83 | HDAC1 (0.45) | HDAC1HDAC8HDAC6PDE4BLMNA | |
| SCHEMBL27682910 | 0.83 | DRD2 (0.49) | HDAC1HDAC8HDAC6LMNATSHR | |
| SCHEMBL5229185 | 0.83 | HDAC1 (0.48) | HDAC1HDAC8HDAC6PDE4B | |
| SCHEMBL5106193 | 0.83 | DRD2 (0.51) | HDAC1HDAC8HDAC6LMNATSHR | |
| SCHEMBL4906065 | 0.80 | IKBKB (0.41) | LMNATSHRKDM4ENPC1MAPT | |
| SCHEMBL4905721 | 0.80 | PPARG (0.49) | LMNATSHRKDM4EHSD17B10GAA | |
| SCHEMBL2225496 | 0.79 | HDAC1 (0.47) | HDAC1HDAC8HDAC6PDE4BLMNA | |
| SCHEMBL6971893 | 0.78 | HDAC1 (0.54) | HDAC1HDAC8HDAC6PDE4BLMNA | |
| SCHEMBL5119297 | 0.76 | HDAC1 (0.51) | HDAC1HDAC8HDAC6LMNATSHR | |
| SCHEMBL31163804 | 0.76 | CYP1A2 (0.37) | LMNATSHRNPC1MAPTRAB9A |
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-1206457-B1 | BIARYL-OXA(THIA)ZOLE DERIVATIVES AND THEIR USE AS PPARS MODULATORS | LILLY CO ELI (US) | 2003-10-15 | — | — | EP | claimed |