Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15776554 | 0.79 | CHRNB2 (0.41) | CYP17A1CHRNB2CHRNA4 | |
| SCHEMBL18017351 | 0.79 | UHRF1 (0.45) | CHRNA7CYP17A1CHRNB2CHRNA4CNR2 | |
| SCHEMBL21355655 | 0.76 | CHRNB2 (0.36) | MGLLCYP17A1CHRNB2CHRNA4 | |
| SCHEMBL25930436 | 0.76 | UHRF1 (0.47) | CHRNA7CYP17A1CNR2UHRF1PDK2 | |
| SCHEMBL21212290 | 0.75 | UHRF1 (0.40) | CHRNA7CYP17A1CNR2UHRF1PDK2 | |
| SCHEMBL20733724 | 0.73 | CHRNA7 (0.40) | CHRNA7CYP17A1CHRNB2CHRNA4CNR2 | |
| SCHEMBL25792497 | 0.73 | CNR2 (0.39) | CHRNA7CYP17A1CNR2CNR1 | |
| SCHEMBL7940997 | 0.72 | CHRNA7 (0.36) | CHRNA7CYP17A1CNR2UHRF1PDK2 | |
| SCHEMBL28115039 | 0.72 | TLR9 (0.42) | CHRNA7CYP17A1UHRF1PDK2PDK4 | |
| SCHEMBL19851269 | 0.72 | MBOAT4 (0.44) | CHRNA7CYP17A1CHRNB2CHRNA4CNR2 |
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-2928867-B1 | PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS | HOFFMANN LA ROCHE (CH) | 2017-08-09 | — | — | EP | disclosed |