Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 18/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.38 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL13282892 | 0.82 | CNR1 (0.57) | CNR1KCNH2CNR2NPC1LMNA | |
| SCHEMBL13282843 | 0.81 | CNR1 (0.45) | CNR1KCNH2CNR2 | |
| SCHEMBL13282974 | 0.78 | CNR1 (0.59) | CNR1KCNH2CNR2CYP1A1CYP2C8 | |
| SCHEMBL13255242 | 0.75 | CNR1 (0.80) | CNR1KCNH2CNR2CYP1A1CYP2C8 | |
| SCHEMBL13437810 | 0.72 | CNR1 (0.48) | CNR1KCNH2CYP1A1CYP2C8CYP2D6 | |
| SCHEMBL13437892 | 0.70 | CNR1 (0.60) | CNR1KCNH2CYP1A1CYP2C8CYP2D6 | |
| SCHEMBL13437706 | 0.70 | CNR1 (0.60) | CNR1KCNH2CYP1A1CYP2C8CYP2D6 | |
| SCHEMBL13283075 | 0.70 | CNR1 (0.60) | CNR1KCNH2CNR2CYP1A1CYP2C8 | |
| SCHEMBL13437780 | 0.65 | CNR1 (0.59) | CNR1KCNH2CYP1A1CYP2C8CYP2D6 | |
| SCHEMBL13437808 | 0.64 | CNR1 (0.53) | CNR1KCNH2CNR2 |
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-7763732-B2 | 7-Chloro-3-({5-[N-(morpholin-1-ylcarboxamido)methyl]aminomethyl}-([1,2,4]-thiadiazol-3-yl))-1-(tetrahydropyran-4-yl)methyl-1H-indole, hydrochloride salt; treatment of pain | N.V. ORGANON (NL) | 2010-07-27 | — | — | US | disclosed |