Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.34 |
| ▸ | ASGR1 | P07306 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15370926 | 0.86 | CA14 (0.39) | CA14HDAC6HDAC1HDAC2SSTR4 | |
| SCHEMBL25124159 | 0.81 | CA14 (0.36) | CA14HDAC6HDAC1HDAC2 | |
| SCHEMBL21203873 | 0.80 | HDAC6 (0.37) | CA14HDAC6HDAC1HDAC2 | |
| SCHEMBL21880331 | 0.80 | HDAC6 (0.37) | CA14HDAC6HDAC1HDAC2ASGR1 | |
| SCHEMBL20442569 | 0.79 | CA12 (0.42) | CA14HDAC6HDAC1HDAC2SSTR4 | |
| SCHEMBL7113790 | 0.79 | SSTR4 (0.42) | CA14HDAC6HDAC1HDAC2SSTR4 | |
| SCHEMBL15597263 | 0.78 | CA14 (0.41) | CA14HDAC6HDAC1HDAC2SSTR4 | |
| SCHEMBL23654550 | 0.76 | CA14 (0.46) | CA14HDAC6HDAC1HDAC2SSTR4 | |
| SCHEMBL24569342 | 0.76 | HDAC6 (0.36) | CA14HDAC6HDAC1HDAC2 | |
| SCHEMBL24880672 | 0.75 | CA14 (0.49) | CA14HDAC6HDAC1HDAC2SSTR4 |
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-1482924-A4 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2006-03-08 | — | — | EP | disclosed |
| EP-1482924-A2 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003075836-A2 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2003-09-18 | — | — | WO | disclosed |