Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 5/20 | 0.42 |
| ▸ | CTSS | P25774 | 5/20 | 0.42 |
| ▸ | CTSK | P43235 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.35 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6689091 | 0.99 | CTSL (0.41) | CTSLCTSSCTSKNPC1RAB9A | |
| SCHEMBL6690788 | 0.89 | CTSD (0.38) | CTSSALDH1A1KMT2AHTR2B | |
| SCHEMBL6686227 | 0.85 | CTSS (0.40) | CTSLCTSSALDH1A1POLB | |
| SCHEMBL6689089 | 0.84 | KMT2A (0.42) | CTSLCTSSALDH1A1KMT2AMEN1 | |
| SCHEMBL6687531 | 0.83 | TRPV1 (0.34) | PYGL | |
| SCHEMBL6687345 | 0.83 | CTSS (0.45) | CTSLCTSSCTSKNPC1RAB9A | |
| SCHEMBL6686236 | 0.82 | GRM7 (0.38) | KMT2AMEN1PYGL | |
| SCHEMBL6685697 | 0.82 | TRPV1 (0.35) | CTSLL3MBTL1 | |
| SCHEMBL6692878 | 0.80 | MEN1 (0.39) | RAB9AKMT2AMEN1L3MBTL1 | |
| SCHEMBL6689424 | 0.80 | TRPV1 (0.34) | PYGL |
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 |