Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL6689978 | 0.86 | SIGMAR1 (0.33) | SIGMAR1RAB9ACTSLCTSS | |
| SCHEMBL6689430 | 0.82 | CTSS (0.37) | SIGMAR1DRD4MAPTNPC1RAB9A | |
| SCHEMBL6693989 | 0.81 | CTSS (0.41) | NPC1RAB9AMEN1KMT2ACTSL | |
| SCHEMBL6688100 | 0.81 | CTSS (0.41) | SIGMAR1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL6688064 | 0.73 | CTSS (0.42) | SIGMAR1DRD4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6693429 | 0.68 | DRD4 (0.39) | DRD4MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6690876 | 0.67 | DRD4 (0.38) | SIGMAR1DRD4MAPTNPC1RAB9A | |
| SCHEMBL8286606 | 0.66 | IDO1 (0.53) | MAPTSMN1; SMN2MEN1KMT2ACTSL | |
| SCHEMBL6690013 | 0.65 | CCR3 (0.40) | SIGMAR1MEN1KMT2ACTSLCTSS | |
| SCHEMBL6698515 | 0.65 | DRD4 (0.39) | DRD4MAPTNPC1RAB9ASMN1; SMN2 |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |