Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | LIPE | Q05469 | 1/20 | 0.35 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | USP5 | P45974 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9408246 | 1.00 | NPC1 (0.36) | NPC1RAB9ATP53SMN1; SMN2TSHR | |
| SCHEMBL9408302 | 0.96 | NPC1 (0.34) | NPC1RAB9ATP53SMN1; SMN2TSHR | |
| SCHEMBL9408293 | 0.96 | NPC1 (0.34) | NPC1RAB9ATP53SMN1; SMN2TSHR | |
| SCHEMBL9408387 | 0.85 | DPP4 (0.39) | NPC1RAB9ASMN1; SMN2HDAC4HDAC2 | |
| SCHEMBL9408307 | 0.85 | MAPT (0.41) | TP53TSHRLMNACCR1MAPT | |
| SCHEMBL9408359 | 0.85 | HDAC2 (0.37) | NPC1RAB9ASLC18A3LMNAHDAC4 | |
| SCHEMBL9408370 | 0.85 | MAPT (0.37) | NPC1RAB9ASMN1; SMN2LMNAFFAR1 | |
| SCHEMBL9408374 | 0.85 | ALDH1A1 (0.41) | RAB9ASMN1; SMN2TSHRLMNAFFAR1 | |
| SCHEMBL9408365 | 0.85 | ALDH1A1 (0.41) | RAB9ASMN1; SMN2TSHRLMNAFFAR1 | |
| SCHEMBL9408262 | 0.82 | THRB (0.41) | — |
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 |