Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.33 |
| ▸ | HTR3A | P46098 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | RAD52 | P43351 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL4701072 | 0.87 | PDCD1 (0.35) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4703746 | 0.86 | OPRM1 (0.37) | HRH3CTSLCTSBCTSSCTSK | |
| SCHEMBL4703639 | 0.83 | CTSK (0.36) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4704896 | 0.83 | CTSK (0.34) | CTSLCTSBCTSSCTSK | |
| SCHEMBL4699572 | 0.83 | CTSL (0.33) | HDAC1CTSLCTSBCTSSCTSK | |
| SCHEMBL4699471 | 0.81 | KCNH2 (0.36) | CTSLCTSBCTSSCTSKKCNH2 | |
| SCHEMBL4701956 | 0.78 | SPHK1 (0.39) | HRH3CTSLCTSBCTSSCTSK | |
| SCHEMBL4704688 | 0.78 | CTSL (0.33) | HRH3CTSLCTSBCTSSCTSK | |
| SCHEMBL4699567 | 0.78 | CTSK (0.44) | CTSLCTSBCTSSCTSKKDR | |
| SCHEMBL4703317 | 0.77 | HRH3 (0.35) | HRH3CTSLCTSBCTSSCTSK |
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 |