Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 8/20 | 0.42 |
| ▸ | FASN | P49327 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | CTSC | P53634 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | HCK | P08631 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL745744 | 0.85 | FAAH (0.46) | FAAHFASNCD274CTSCHSD11B1 | |
| SCHEMBL745745 | 0.85 | FAAH (0.46) | FAAHFASNCD274CTSCHSD11B1 | |
| Fumaric Acid SCHEMBL748371 | 0.77 | CCNC (0.43) | FAAHFASNCD274CHRNA7CTSC | |
| Fumaric Acid SCHEMBL748370 | 0.77 | CCNC (0.43) | FAAHFASNCD274CHRNA7CTSC | |
| SCHEMBL13786855 | 0.64 | HSD11B1 (0.55) | FAAHFASNCD274CHRNA7HSD11B1 | |
| SCHEMBL5256926 | 0.64 | HSD11B1 (0.69) | FAAHFASNHSD11B1LRRK2 | |
| SCHEMBL30241674 | 0.64 | HSD11B1 (0.69) | FAAHFASNHSD11B1LRRK2 | |
| SCHEMBL28318034 | 0.63 | PRKCI (0.52) | FAAHFASNCD274HSD11B1LRRK2 | |
| SCHEMBL748131 | 0.63 | CHRNA7 (0.44) | CHRNA7KCNH2 | |
| SCHEMBL748442 | 0.63 | NPC1 (0.44) | CHRNA7NPC1RAB9AKCNH2ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2431368-A1 | CNS active fused bicycloheterocycle substituted azabicyclic alkane derivatives | Abbott Laboratories (US) | 2012-03-21 | — | — | EP | disclosed |