Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 2/20 | 0.33 |
| ▸ | CDK9 | P50750 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 4/20 | 0.31 |
| ▸ | CA1 | P00915 | 4/20 | 0.31 |
| ▸ | CA2 | P00918 | 4/20 | 0.31 |
| ▸ | CA9 | Q16790 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6689978 | 0.77 | SIGMAR1 (0.33) | — | |
| SCHEMBL6686186 | 0.72 | CCNT1 (0.36) | CCNT1CDK9CA12CA1CA2 | |
| SCHEMBL6693024 | 0.67 | GPR119 (0.36) | CCNT1CDK9 | |
| SCHEMBL6694455 | 0.65 | CTSS (0.39) | CCNT1CDK9 | |
| SCHEMBL17751111 | 0.65 | NQO2 (0.44) | CA12CA1CA2CA9 | |
| SCHEMBL12696399 | 0.65 | NQO2 (0.44) | CA12CA1CA2CA9 | |
| SCHEMBL29572544 | 0.61 | EPHX2 (0.50) | — | |
| SCHEMBL20505740 | 0.61 | EPHX2 (0.50) | — | |
| SCHEMBL12363994 | 0.60 | CMA1 (0.42) | — | |
| SCHEMBL27739871 | 0.60 | CMA1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004112709-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-12-29 | — | — | WO | disclosed |
| WO-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |