Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 8/20 | 0.46 |
| ▸ | CTSS | P25774 | 7/20 | 0.46 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15627772 | 0.90 | CTSK (0.47) | CTSKCTSSCAPN1F10MEN1 | |
| SCHEMBL29711843 | 0.87 | CTSK (0.52) | CTSKCTSSCAPN1F10MEN1 | |
| SCHEMBL29711719 | 0.86 | CTSS (0.45) | CTSKCTSSCAPN1F10MEN1 | |
| SCHEMBL7106632 | 0.86 | CAPN1 (0.56) | CTSKCTSSCAPN1MEN1GAA | |
| SCHEMBL17002536 | 0.85 | CTSS (0.43) | CTSKCTSSCAPN1F10MEN1 | |
| SCHEMBL13331674 | 0.83 | CTSK (0.49) | CTSKCTSSCAPN1MEN1GAA | |
| SCHEMBL19788394 | 0.82 | CTSK (0.41) | CTSKCTSSCAPN1F10MEN1 | |
| SCHEMBL25469335 | 0.82 | MEN1 (0.49) | CTSKCTSSCAPN1MEN1GAA | |
| SCHEMBL21724458 | 0.82 | MEN1 (0.51) | CTSKCTSSCAPN1MEN1GAA | |
| SCHEMBL21724453 | 0.82 | MEN1 (0.51) | CTSKCTSSCAPN1MEN1GAA |
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-9872919-B2 | Prodrugs for selective anticancer therapy | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2018-01-23 | — | — | US | disclosed |