Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 9/20 | 0.37 |
| ▸ | CTSS | P25774 | 6/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.32 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL15462624 | 0.83 | SMN1; SMN2 (0.49) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL20052397 | 0.81 | SMN1; SMN2 (0.49) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL15462650 | 0.81 | SMN1; SMN2 (0.49) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL19944912 | 0.81 | SMN1; SMN2 (0.49) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL14743954 | 0.79 | SMN1; SMN2 (0.59) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL14743953 | 0.79 | SMN1; SMN2 (0.59) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL25749303 | 0.78 | SMN1; SMN2 (0.60) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL13139840 | 0.77 | SMN1; SMN2 (0.50) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL646203 | 0.77 | SMN1; SMN2 (0.50) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 | |
| SCHEMBL645609 | 0.77 | SMN1; SMN2 (0.50) | SMN1; SMN2CTSKCTSSCYP1A2CYP2C9 |
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-2697246-B1 | SELECTIVE CYSTEINE PROTEASE INHIBITORS AND USES THEREOF | GENESIS TECH LIMITED (BB) | 2018-03-07 | — | — | EP | disclosed |