Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 2/20 | 0.48 |
| ▸ | MGLL | Q99685 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7013747 | 0.90 | CYP1A2 (0.53) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL27486362 | 0.88 | CYP1A2 (0.53) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL9173899 | 0.82 | CYP1A2 (0.60) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL8479242 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL8776624 | 0.79 | CYP1A2 (0.61) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL8484132 | 0.79 | CYP1A2 (0.55) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL8483965 | 0.78 | MAPT (0.65) | CYP1A2CYP2D6MGLL | |
| SCHEMBL8487645 | 0.78 | CYP1A2 (0.48) | CYP1A2CYP2D6FAAHMGLL | |
| SCHEMBL10459207 | 0.78 | CYP1A2 (0.69) | CYP1A2CYP2D6MGLL | |
| SCHEMBL8838148 | 0.77 | MGLL (0.48) | CYP1A2CYP2D6FAAHMGLL |
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 |
|---|---|---|---|---|---|---|---|
| CN-1183770-A | Piperazine derivatives, medicaments containing these compounds, their use and processes for their preparation | THOMAE GMBH DR K (DE) | 1998-06-03 | — | — | CN | disclosed |