Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | USP5 | P45974 | 1/20 | 0.34 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.33 |
| ▸ | LIPE | Q05469 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.32 |
| ▸ | CHRNG | P07510 | 1/20 | 0.32 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9408302 | 1.00 | NPC1 (0.34) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL9408252 | 0.96 | NPC1 (0.36) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL9408246 | 0.96 | NPC1 (0.36) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL9408253 | 0.86 | HDAC2 (0.35) | NPC1RAB9AUSP5SLC18A3HDAC2 | |
| SCHEMBL9408288 | 0.86 | DPP4 (0.37) | NPC1RAB9ASMN1; SMN2USP5CCR1 | |
| SCHEMBL9408244 | 0.86 | BCL2L1 (0.39) | TP53TSHRLMNACCR1 | |
| SCHEMBL9408426 | 0.86 | ALDH1A1 (0.39) | SMN1; SMN2USP5LMNASLC6A2SLC6A4 | |
| SCHEMBL9408436 | 0.86 | ALDH1A1 (0.39) | SMN1; SMN2USP5LMNASLC6A2SLC6A4 | |
| SCHEMBL9408190 | 0.86 | MAPT (0.35) | NPC1RAB9ASMN1; SMN2LMNASLC6A3 | |
| SCHEMBL9408354 | 0.84 | THRB (0.39) | SLC6A3 |
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 |