Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 8/20 | 0.72 |
| ▸ | ITGB1 | P05556 | 10/20 | 0.50 |
| ▸ | ITGA4 | P13612 | 10/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL288051 | 1.00 | CAPN1 (0.72) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL289537 | 1.00 | CAPN1 (0.72) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL289787 | 1.00 | CAPN1 (0.72) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL1611991 | 0.91 | CAPN1 (0.80) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL1613248 | 0.91 | CAPN1 (0.80) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL1612803 | 0.91 | CAPN1 (0.80) | CAPN1ITGB1ITGA4SIGMAR1P2RX7 | |
| SCHEMBL288920 | 0.90 | CAPN1 (0.77) | CAPN1ITGB1ITGA4P2RX7 | |
| SCHEMBL1613533 | 0.90 | CAPN1 (0.77) | CAPN1ITGB1ITGA4P2RX7 | |
| SCHEMBL1613008 | 0.90 | CAPN1 (0.77) | CAPN1ITGB1ITGA4P2RX7 | |
| SCHEMBL289056 | 0.89 | CAPN1 (0.69) | CAPN1ITGB1ITGA4P2RX7 |
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-2427429-A1 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS | Abbott GmbH & Co. KG (DE) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128102-A1 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS CALPAIN INHIBITORS | ABBOTT GMBH & CO. KG (DE) | 2010-11-11 | — | — | WO | disclosed |