Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 2/20 | 0.40 |
| ▸ | CTSS | P25774 | 3/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 2/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 3/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5731226 | 0.86 | CTSK (0.46) | CTSSCTSKMAPTATMALDH1A1 | |
| SCHEMBL5731227 | 0.86 | CTSK (0.46) | CTSSCTSKMAPTATMALDH1A1 | |
| SCHEMBL6347225 | 0.77 | KLK5 (0.49) | CTSSCTSKCTSBCTSLMAPT | |
| SCHEMBL6415412 | 0.76 | NPC1 (0.35) | CTSKMAPTPTPN2PTPN1TP53 | |
| SCHEMBL5736602 | 0.76 | NPC1 (0.42) | CTSSCTSKCTSLMAPTATM | |
| SCHEMBL5736600 | 0.76 | NPC1 (0.42) | CTSSCTSKCTSLMAPTATM | |
| SCHEMBL6062065 | 0.75 | CTSS (0.41) | CTSSCTSKMAPTATMRAB9A | |
| SCHEMBL6062057 | 0.75 | CTSS (0.41) | CTSSCTSKMAPTATMRAB9A | |
| SCHEMBL6062062 | 0.75 | CTSS (0.41) | CTSSCTSKMAPTATMRAB9A | |
| SCHEMBL6696297 | 0.75 | CTSS (0.41) | CTSSCTSKMAPTATMRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002023784-A2 | CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-03-21 | — | — | WO | disclosed |