Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 2/20 | 0.60 |
| ▸ | DPP4 | P27487 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 7/20 | 0.48 |
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.47 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.47 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.47 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.47 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.47 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12860064 | 0.90 | TTR (0.51) | TTRDPP4CYP3A4MAOBCA12 | |
| SCHEMBL1239568 | 0.87 | PSEN1 (0.61) | MAOBAPPFDPSPSEN1PSEN2 | |
| SCHEMBL1239565 | 0.87 | PSEN1 (0.61) | MAOBAPPFDPSPSEN1PSEN2 | |
| SCHEMBL8060709 | 0.78 | KDM4E (0.43) | APPPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL1239462 | 0.77 | PSEN1 (0.54) | APPPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL10281385 | 0.77 | PSEN1 (0.40) | APPPSEN1PSEN2APH1BNCSTN | |
| Ethyl Caffeate SCHEMBL31059266 | 0.76 | TTR (1.00) | TTRDPP4CYP3A4MAOBCA12 | |
| Ethyl Caffeate SCHEMBL30286241 | 0.76 | TTR (1.00) | TTRDPP4CYP3A4MAOBCA12 | |
| Ethyl Caffeate SCHEMBL782033 | 0.76 | TTR (1.00) | TTRDPP4CYP3A4MAOBCA12 | |
| Ethyl Caffeate SCHEMBL22196845 | 0.76 | TTR (1.00) | TTRDPP4CYP3A4MAOBCA12 |
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-2009108766-A1 | GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER ' S DISEASE | SCHERING CORPORATION (US) | 2009-09-03 | — | — | WO | disclosed |