Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 6/20 | 0.48 |
| ▸ | PSEN2 | P49810 | 6/20 | 0.48 |
| ▸ | APH1B | Q8WW43 | 6/20 | 0.48 |
| ▸ | NCSTN | Q92542 | 6/20 | 0.48 |
| ▸ | APH1A | Q96BI3 | 6/20 | 0.48 |
| ▸ | PSENEN | Q9NZ42 | 6/20 | 0.48 |
| ▸ | CTSS | P25774 | 2/20 | 0.38 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSC | P53634 | 3/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL5345197 | 0.78 | NPC1 (0.39) | CTSSCTSK | |
| SCHEMBL6386068 | 0.78 | TRPV1 (0.44) | CTSSCTSK | |
| SCHEMBL6386072 | 0.78 | TRPV1 (0.44) | CTSSCTSK | |
| Acetic Acid SCHEMBL6384093 | 0.78 | CTSC (0.44) | CTSSCTSKCTSBCTSCKCNH2 | |
| SCHEMBL6838943 | 0.77 | GAA (0.41) | CTSSCTSKCTSB | |
| SCHEMBL6382256 | 0.77 | NPC1 (0.52) | CTSSCTSKCTSCKCNH2 | |
| SCHEMBL6382259 | 0.77 | NPC1 (0.52) | CTSSCTSKCTSCKCNH2 | |
| SCHEMBL5255969 | 0.77 | GAA (0.41) | CTSSCTSKCTSB | |
| SCHEMBL6381865 | 0.77 | ADAM17 (0.40) | CTSSCTSK | |
| SCHEMBL6380546 | 0.77 | SSTR3 (0.46) | CTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-6759428-B2 | SUCH AS N-((1,2)-2-(((CYANO(CYCLOPROPYL)METHYL)AMINO)CARBONYL) CYCLOHEXYL)-1H-INDOLE-2-CARBOXAMIDE; CATHEPSIN K INHIBITORS | ROCHE PALO ALTO LLC | 2004-07-06 | — | — | US | disclosed |