Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 5/20 | 0.46 |
| ▸ | CTSS | P25774 | 4/20 | 0.46 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16383458 | 0.91 | CYP1A2 (0.51) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL19944912 | 0.88 | SMN1; SMN2 (0.49) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL15462650 | 0.88 | SMN1; SMN2 (0.49) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL20052397 | 0.88 | SMN1; SMN2 (0.49) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL8466501 | 0.82 | CTSS (0.59) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL8466502 | 0.82 | CTSS (0.59) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL20355989 | 0.82 | SMN1; SMN2 (0.45) | CTSKCTSSPSENENSMN1; SMN2REN | |
| SCHEMBL31250500 | 0.81 | CTSK (0.49) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL10144173 | 0.81 | CYP1A2 (0.48) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL30064534 | 0.79 | CTSK (0.45) | CYP1A2CYP2C9CYP2C19HTTCTSK |
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-9944674-B2 | Selective cysteine protease inhibitors and uses thereof | GENESIS TECHNOLOGIES LIMITED (BB) | 2018-04-17 | — | — | US | disclosed |