Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CHUK | O15111 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.31 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.31 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.31 |
| ▸ | LGMN | Q99538 | 1/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4703317 | 0.91 | HRH3 (0.35) | CTSLCTSBCTSSCTSKHRH3 | |
| SCHEMBL4703269 | 0.89 | ATP4A (0.36) | CTSLCTSSCTSKCHUKINSR | |
| SCHEMBL4704896 | 0.88 | CTSK (0.34) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703612 | 0.87 | CTSS (0.34) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4701830 | 0.86 | CTSK (0.37) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703639 | 0.86 | CTSK (0.36) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4701072 | 0.85 | PDCD1 (0.35) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703746 | 0.84 | OPRM1 (0.37) | CTSLCTSBCTSSCTSKHRH3 | |
| SCHEMBL4699887 | 0.83 | CTSS (0.34) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4699471 | 0.82 | KCNH2 (0.36) | CTSLCTSBCTSSCTSK |
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-1372655-B1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2008-10-01 | — | — | EP | disclosed |