Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8465845 | 0.78 | ACHE (0.35) | PTGS2PTGS1NPC1TDP1 | |
| SCHEMBL4285266 | 0.74 | HSD17B1 (0.40) | PTGS2PTGS1MCL1 | |
| SCHEMBL11269403 | 0.74 | PDCD1 (0.42) | PTGS2PTGS1HTR7ALDH1A1LMNA | |
| SCHEMBL15453986 | 0.73 | ALDH1A1 (0.34) | MAPTALDH1A1LMNACNR1CNR2 | |
| SCHEMBL1996693 | 0.73 | ACHE (0.39) | NOTUMHTR7MAPTNPC1 | |
| SCHEMBL11203627 | 0.73 | PTGS2 (0.41) | PTGS2PTGS1NOTUMHTR7MAPT | |
| SCHEMBL4280005 | 0.72 | HPGDS (0.40) | PTGS2PTGS1NPC1 | |
| SCHEMBL8074720 | 0.71 | NOTUM (0.35) | PTGS2NOTUMMAPTMCL1ALDH1A1 | |
| SCHEMBL308889 | 0.69 | HTR7 (0.44) | PTGS2PTGS1HTR7ALDH1A1NPC1 | |
| SCHEMBL446052 | 0.69 | MAPT (0.37) | MAPTALDH1A1LMNANPC1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997041108-A1 | SUBSTITUTED PIPERAZINES AND PIPERIDINES AS CENTRAL NERVOUS SYSTEM AGENTS | WARNER-LAMBERT COMPANY (US) | 1997-11-06 | — | — | WO | disclosed |