Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.70 |
| ▸ | CAPN2 | P17655 | 1/20 | 0.70 |
| ▸ | CTSK | P43235 | 15/20 | 0.69 |
| ▸ | CTSS | P25774 | 6/20 | 0.66 |
| ▸ | CTSL | P07711 | 2/20 | 0.66 |
| ▸ | CTSB | P07858 | 1/20 | 0.66 |
| ▸ | CA5A | P35218 | 1/20 | 0.63 |
| ▸ | CA1 | P00915 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL12829139 | 0.88 | CTSK (0.72) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL9115066 | 0.85 | CAPN1 (0.80) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL29052549 | 0.84 | CTSK (0.77) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL29052552 | 0.84 | CTSK (0.77) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL14067668 | 0.84 | CTSK (0.77) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL7183327 | 0.81 | CTSK (0.73) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL6361583 | 0.81 | CTSK (0.76) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL6364364 | 0.81 | CTSK (0.76) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL5443106 | 0.81 | CAPN1 (0.74) | CAPN1CAPN2CTSKCTSSCTSL | |
| SCHEMBL6358735 | 0.81 | CTSK (0.69) | CAPN1CAPN2CTSKCTSSCTSL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1028942-A2 | DIPEPTIDE NITRILES | Novartis AG (CH) | 2000-08-23 | — | — | EP | disclosed |
| WO-1999024460-A2 | DIPEPTIDE NITRILES | NOVARTIS AG (CH) | 1999-05-20 | — | — | WO | disclosed |