Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 6/20 | 0.46 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22338809 | 0.79 | CA1 (0.51) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL14037661 | 0.79 | CA1 (0.51) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL1372066 | 0.78 | AAK1 (0.48) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL21904477 | 0.78 | AAK1 (0.48) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL1372065 | 0.78 | AAK1 (0.48) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL6610106 | 0.78 | GAA (0.48) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL1370068 | 0.78 | CTSK (0.48) | CTSKCTSSBTKAAK1CA1 | |
| SCHEMBL6512296 | 0.77 | GAA (0.46) | CTSKCTSSGAAEPHX1HDAC4 | |
| SCHEMBL4044570 | 0.76 | CA12 (0.40) | EPHX1CA1CA2KMT2A | |
| SCHEMBL24103813 | 0.76 | AAK1 (0.49) | CTSKCTSSGAAEPHX1HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101501061-A | Macrocyclic compounds as antiviral agents | ANGELETTI P IST RICHERCHE BIO (IT) | 2009-08-05 | — | — | CN | disclosed |
| US-5866684-A | Peptidyl inhibitors of viral proteases | HOFFMANN-LA ROCHE INC. (US) | 1999-02-02 | — | — | US | disclosed |