Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 19/20 | 0.73 |
| ▸ | CTSL | P07711 | 2/20 | 0.56 |
| ▸ | CTSB | P07858 | 2/20 | 0.56 |
| ▸ | CTSS | P25774 | 2/20 | 0.55 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.54 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.54 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.54 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6942085 | 1.00 | CAPN1 (0.73) | CAPN1CTSLCTSBCTSSCHRNB2 | |
| SCHEMBL3642696 | 0.89 | CAPN1 (0.60) | CAPN1CTSBCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3642692 | 0.89 | CAPN1 (0.60) | CAPN1CTSBCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3641713 | 0.89 | CAPN1 (0.60) | CAPN1CTSBCHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22897166 | 0.86 | CAPN1 (0.57) | CAPN1CTSLCTSBCTSSCTSK | |
| SCHEMBL2802437 | 0.85 | CAPN1 (0.88) | CAPN1CTSLCTSBCTSS | |
| SCHEMBL2796763 | 0.85 | CAPN1 (1.00) | CAPN1CTSLCTSBCTSS | |
| SCHEMBL7501365 | 0.85 | CAPN1 (0.62) | CAPN1CTSLCTSBCTSS | |
| SCHEMBL1333616 | 0.85 | CAPN1 (0.57) | CAPN1CTSS | |
| SCHEMBL6939927 | 0.84 | CAPN1 (0.55) | CAPN1CHRNB2CHRNB4CHRNA3CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6103720-A | ENZYME INHIBITORS; ANTIICHEMIC AND -TUMOR AGENTS; STROKES; ALZEIMER'S DISEASE | BASF AKTIENGESELLSCHAFT (DE) | 2000-08-15 | — | — | US | disclosed |