Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CHAT | P28329 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | HNF4A | P41235 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL2532692 | 0.83 | TTR (0.37) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL28697334 | 0.83 | CHAT (0.35) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL27693757 | 0.82 | MAOB (0.37) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL9344854 | 0.82 | MAOB (0.37) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL29036461 | 0.79 | LCK (0.44) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL27570573 | 0.78 | HDAC1 (0.37) | TTRALOX5PTGS1PTGS2MEN1 | |
| SCHEMBL4438933 | 0.78 | MAOB (0.39) | TRPA1TTRALOX5PTGS1PTGS2 | |
| SCHEMBL27790759 | 0.78 | MAPT (0.45) | MEN1MAPTKMT2AMAOBCYP19A1 | |
| SCHEMBL9546943 | 0.77 | HDAC1 (0.36) | TTRALOX5PTGS1PTGS2MAPT | |
| SCHEMBL2905608 | 0.77 | TTR (0.36) | TRPA1TTRALOX5PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0625979-A1 | AZABRICYCLIC COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-11-30 | — | — | EP | disclosed |
| WO-1993015073-A1 | AZABRICYCLIC COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-08-05 | — | — | WO | disclosed |