Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
| ▸ | CTSK | P43235 | 15/20 | 0.56 |
| ▸ | CTSS | P25774 | 7/20 | 0.56 |
| ▸ | CTSL | P07711 | 3/20 | 0.56 |
| ▸ | CTSB | P07858 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.50 |
| ▸ | CAPN2 | P17655 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7164038 | 0.95 | CTSK (0.62) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL7165081 | 0.83 | CTSK (0.51) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL7610538 | 0.82 | CTSK (0.56) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL7815915 | 0.82 | CTSK (0.55) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL5934588 | 0.81 | CTSK (0.63) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL27575296 | 0.81 | CTSK (0.69) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL27575295 | 0.81 | CTSK (0.69) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL7167212 | 0.81 | CTSK (0.69) | CTSKCTSSCTSLCTSBCAPN1 | |
| SCHEMBL7611750 | 0.80 | CTSK (0.67) | CA5ACTSKCTSSCTSLCTSB | |
| SCHEMBL7240364 | 0.80 | CTSK (0.53) | CA5ACTSKCTSSCTSLCTSB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1068304-A4 | TREATMENT OF PARASITIC DISEASES BY INHIBITION OF CYSTEINE PROTEASES OF THE PAPAIN SUPERFAMILY | SMITHKLINE BEECHAM CORP (US) | 2001-05-09 | — | — | EP | disclosed |
| EP-1068304-A1 | TREATMENT OF PARASITIC DISEASES BY INHIBITION OF CYSTEINE PROTEASES OF THE PAPAIN SUPERFAMILY | SMITHKLINE BEECHAM CORPORATION (US) | 2001-01-17 | — | — | EP | disclosed |
| WO-1999053039-A1 | TREATMENT OF PARASITIC DISEASES BY INHIBITION OF CYSTEINE PROTEASES OF THE PAPAIN SUPERFAMILY | SMITHKLINE BEECHAM CORPORATION (US) | 1999-10-21 | — | — | WO | disclosed |