Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | USP5 | P45974 | 2/20 | 0.34 |
| ▸ | PRCP | P42785 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.30 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL9408359 | 0.96 | HDAC2 (0.37) | HDAC2HDAC6HDAC8HDAC3HDAC11 | |
| SCHEMBL9408288 | 0.86 | DPP4 (0.37) | HDAC2USP5NPC1RAB9AHDAC4 | |
| SCHEMBL9408302 | 0.86 | NPC1 (0.34) | HDAC2USP5NPC1RAB9ASLC18A3 | |
| SCHEMBL9408293 | 0.86 | NPC1 (0.34) | HDAC2USP5NPC1RAB9ASLC18A3 | |
| SCHEMBL9408244 | 0.86 | BCL2L1 (0.39) | PRCPCYP2C9CYP1A2MAPT | |
| SCHEMBL9408388 | 0.83 | GRIA1 (0.42) | — | |
| SCHEMBL9408325 | 0.83 | HTR2C (0.41) | KIF11 | |
| SCHEMBL9408190 | 0.83 | MAPT (0.35) | NPC1RAB9ACYP2C9ALDH1A1MAPT | |
| SCHEMBL9408426 | 0.83 | ALDH1A1 (0.39) | USP5LDHAALDH1A1MAPT | |
| SCHEMBL9408378 | 0.83 | GRIA1 (0.42) | — |
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-0595144-A1 | Cyclohexyl alkenoates as components of liquid crystalline mixtures | F. HOFFMANN-LA ROCHE AG (CH) | 1994-05-04 | — | — | EP | disclosed |