Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 11/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | HSD11B2 | P80365 | 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 | |
|---|---|---|---|---|
| SCHEMBL7083692 | 0.80 | SIGMAR1 (0.39) | P2RX7HDAC4CNR2HSD11B1HSD11B2 | |
| SCHEMBL7079060 | 0.76 | HDAC4 (0.38) | GAASMN1; SMN2HDAC4HSD11B1 | |
| SCHEMBL7078036 | 0.76 | HDAC4 (0.39) | P2RX7HDAC4CNR2HSD11B1 | |
| SCHEMBL12760777 | 0.76 | MEN1 (0.35) | P2RX7NPC1LMNARAB9ANPSR1 | |
| SCHEMBL4607913 | 0.75 | P2RX7 (0.40) | P2RX7LMNAHTTNPSR1CNR2 | |
| SCHEMBL7079601 | 0.69 | HSP90AA1 (0.33) | P2RX7NPC1LMNAGAAHTT | |
| SCHEMBL24626840 | 0.68 | PDK2 (0.37) | P2RX7HTTCNR2OPRK1 | |
| SCHEMBL27869456 | 0.66 | HTT (0.43) | P2RX7HTTSMN1; SMN2HSD11B1 | |
| SCHEMBL30688050 | 0.65 | KDM1A (0.46) | P2RX7KDM1AOPRK1HSD11B1 | |
| SCHEMBL30978073 | 0.65 | MAPT (0.37) | P2RX7NPC1GAAHTTRAB9A |
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-2003064372-A1 | 2-ADAMANTYLALKYLAMINES AND THEIR USE IN THE TREATMENT OF CONDITIONS GENERALLY ASSOCIATED WITH ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION | VERNALIS RESEARCH LIMITED (GB) | 2003-08-07 | — | — | WO | disclosed |