Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 3/20 | 0.36 |
| ▸ | CTSS | P25774 | 3/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL5592803 | 0.91 | CTSS (0.41) | CHEK1ACHECTSLCTSSCTSK | |
| SCHEMBL5592852 | 0.88 | CTSL (0.43) | CTSLCTSSCTSKCTSBKDM4E | |
| SCHEMBL5592632 | 0.85 | CTSL (0.45) | CTSLCTSSCTSKCTSBKDM4E | |
| SCHEMBL5593180 | 0.84 | CTSL (0.45) | ACHECTSLCTSSCTSKCTSB | |
| SCHEMBL5592732 | 0.84 | CTSL (0.45) | ACHECTSLCTSSCTSKCTSB | |
| SCHEMBL5593179 | 0.83 | CTSL (0.51) | CHEK1ACHECTSLCTSSCTSK | |
| SCHEMBL5592898 | 0.82 | CTSL (0.43) | ACHECTSLCTSSCTSKCTSB | |
| Trifluoroacetic Acid SCHEMBL5592740 | 0.79 | CTSL (0.47) | CHEK1ACHECTSLCTSSCTSK | |
| SCHEMBL5592691 | 0.78 | CTSS (0.49) | CTSLCTSSCTSKCTSBHDAC1 | |
| SCHEMBL5592894 | 0.75 | CTSL (0.45) | CTSLCTSSCTSKCTSBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007025775-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |