Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | AR | P10275 | 1/20 | 0.51 |
| ▸ | SMO | Q99835 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HTR7 | P34969 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 1/20 | 0.45 |
| ▸ | HRH2 | P25021 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL21384787 | 0.76 | MAPT (0.49) | NPC1RAB9AMAPTTSHRHTR7 | |
| SCHEMBL5338313 | 0.74 | SMO (0.59) | NPC1RAB9ASMOTSHRRECQL | |
| SCHEMBL8235059 | 0.73 | MAPT (0.79) | NPC1RAB9AARMAPTHTR7 | |
| SCHEMBL4751033 | 0.71 | SMO (0.59) | SMOMAPTTSHRDRD3ALDH1A1 | |
| SCHEMBL13020231 | 0.71 | OPRM1 (0.47) | NPC1RAB9ASMOTSHRRECQL | |
| SCHEMBL7730871 | 0.71 | NPC1 (0.68) | NPC1RAB9AARMAPTSIGMAR1 | |
| SCHEMBL19981211 | 0.71 | MAPT (0.54) | MAPTHTTMAPK1 | |
| SCHEMBL4754231 | 0.70 | BLM (0.48) | NPC1RAB9ASMOMAPTOPRM1 | |
| SCHEMBL9819732 | 0.70 | TSHR (0.71) | NPC1MAPTSIGMAR1TSHRHTR7 | |
| SCHEMBL20306240 | 0.70 | AR (0.65) | NPC1RAB9AARMAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008147864-A2 | METHODS OF USING PIPERAZINE COMPOUNDS IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS | XENON PHARMACEUTICALS INC. (CA) | 2008-12-04 | — | — | WO | claimed |
| WO-2008147864-A2 | METHODS OF USING PIPERAZINE COMPOUNDS IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS | XENON PHARMACEUTICALS INC. (CA) | 2008-12-04 | — | — | WO | disclosed |