Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CTSG | P08311 | 1/20 | 0.33 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5445816 | 0.81 | HPGD (0.40) | KMT2AMDM2HPGDSLC1A3SLC1A2 | |
| SCHEMBL7551628 | 0.71 | CTSS (0.49) | CTSL | |
| SCHEMBL5445806 | 0.69 | ALDH1A1 (0.34) | KMT2APRSS1F2PRSS2PRSS3 | |
| SCHEMBL6557583 | 0.67 | SLC1A3 (0.37) | PRSS1F2PRSS2PRSS3SLC1A3 | |
| SCHEMBL6560207 | 0.66 | GRM7 (0.37) | PRSS1F2PRSS2PRSS3SLC1A3 | |
| SCHEMBL6062861 | 0.65 | PRSS1 (0.49) | KMT2APRSS1F2PRSS2PRSS3 | |
| SCHEMBL7256952 | 0.65 | PRSS1 (0.49) | KMT2APRSS1F2PRSS2PRSS3 | |
| SCHEMBL6559792 | 0.64 | USP2 (0.39) | PRSS1F2HPGDSLC1A3SLC1A2 | |
| SCHEMBL10444753 | 0.64 | CES1 (0.52) | MDM2KDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL6557593 | 0.64 | KEAP1 (0.41) | MMP1MMP2MMP9MMP8MMP13 |
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-1436255-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | Aventis Pharmaceuticals, Inc. (US) | 2004-07-14 | — | — | EP | claimed |
| WO-2003024924-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2003-03-27 | — | — | WO | claimed |