Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6686987 | 0.89 | CTSL (0.42) | ALDH1A1CTSSHTR2BKMT2A | |
| SCHEMBL6689091 | 0.88 | CTSL (0.41) | ALDH1A1CTSSHTR2BKMT2A | |
| SCHEMBL6689089 | 0.86 | KMT2A (0.42) | ALDH1A1CTSSKMT2AEPHX2NAMPT | |
| SCHEMBL6686227 | 0.82 | CTSS (0.40) | ALDH1A1CTSS | |
| SCHEMBL6688308 | 0.81 | CTSS (0.47) | CTSDBACE1BACE2ALDH1A1HSD17B10 | |
| SCHEMBL6687345 | 0.81 | CTSS (0.45) | ALDH1A1HDAC8CTSSKMT2A | |
| SCHEMBL6689428 | 0.80 | MEN1 (0.41) | ALDH1A1KMT2A | |
| SCHEMBL6686236 | 0.80 | GRM7 (0.38) | TDP1KMT2A | |
| SCHEMBL6685697 | 0.80 | TRPV1 (0.35) | — | |
| SCHEMBL6692878 | 0.78 | MEN1 (0.39) | KMT2A |
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 |