Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | LIPC | P11150 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MMP1 | P03956 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | MMP7 | P09237 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL5440673 | 0.85 | LARS1 (0.41) | CTSKCTSSLARS1GBA1CASP1 | |
| SCHEMBL6557593 | 0.68 | KEAP1 (0.41) | CTSKCTSSGBA1CASP1ALDH1A1 | |
| SCHEMBL5484256 | 0.67 | CTSK (0.33) | CTSKCTSSMMP2MMP9 | |
| SCHEMBL5441961 | 0.65 | CA2 (0.41) | CA2CA1CA12CA9ALDH1A1 | |
| SCHEMBL6843005 | 0.64 | CTSS (0.53) | CTSKCTSSHSD17B10ALDH1A1 | |
| SCHEMBL14491115 | 0.64 | CTSS (0.53) | CTSKCTSSHSD17B10ALDH1A1 | |
| SCHEMBL6742782 | 0.64 | CTSC (0.49) | CTSKCTSSHPGD | |
| SCHEMBL5471723 | 0.64 | PRMT1 (0.40) | CTSKCTSSCASP1ALDH1A1MMP1 | |
| SCHEMBL6742169 | 0.62 | CTSC (0.47) | CTSKCTSSHPGD | |
| SCHEMBL6742769 | 0.62 | CTSC (0.47) | CTSKCTSSHPGD |
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-7196099-B2 | Compounds and compositions as cathepsin inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2007-03-27 | — | — | US | disclosed |