Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 13/20 | 0.35 |
| ▸ | CTSK | P43235 | 12/20 | 0.35 |
| ▸ | CTSL | P07711 | 3/20 | 0.34 |
| ▸ | CTSB | P07858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2153074 | 0.76 | LTA4H (0.36) | CTSKMEN1GAAKMT2A | |
| SCHEMBL11455313 | 0.74 | CTSK (0.41) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL15268573 | 0.71 | CTSK (0.44) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL4588098 | 0.69 | CTSK (0.35) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL11656712 | 0.68 | ALDH1A1 (0.34) | — | |
| SCHEMBL3183887 | 0.67 | MEN1 (0.36) | CTSSCTSKMEN1GAAKMT2A | |
| SCHEMBL397677 | 0.66 | CA2 (0.37) | MEN1GAAKMT2A | |
| SCHEMBL6901600 | 0.66 | CA12 (0.37) | CTSSCTSKMEN1GAAKMT2A | |
| SCHEMBL2139570 | 0.66 | CA12 (0.37) | CTSSCTSKMEN1GAAKMT2A | |
| SCHEMBL16967740 | 0.66 | MEN1 (0.33) | CTSSCTSKCTSLCTSBMEN1 |
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-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |