Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | CTSL | P07711 | 11/20 | 0.60 |
| ▸ | CTSK | P43235 | 11/20 | 0.60 |
| ▸ | CTSS | P25774 | 7/20 | 0.60 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 6/20 | 0.45 |
| ▸ | MMP9 | P14780 | 6/20 | 0.45 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7449155 | 0.86 | CTSL (0.60) | ALDH1A1CTSLCTSKCTSSCTSB | |
| SCHEMBL8086163 | 0.79 | CTSK (0.79) | CTSLCTSKCTSSCTSB | |
| SCHEMBL31086837 | 0.77 | ALDH1A1 (1.00) | ALDH1A1MAPTMMP2MMP9ADAMTS4 | |
| SCHEMBL31086912 | 0.77 | ALDH1A1 (0.80) | ALDH1A1MAPTMMP2MMP9ADAMTS4 | |
| SCHEMBL7436896 | 0.76 | CTSK (0.67) | CTSLCTSKCTSSCTSB | |
| SCHEMBL7160147 | 0.75 | CTSK (1.00) | CTSLCTSKCTSSCTSB | |
| SCHEMBL7161878 | 0.75 | CTSK (0.72) | CTSLCTSKCTSSCTSB | |
| SCHEMBL8086228 | 0.74 | CTSK (0.49) | CTSLCTSKCTSSCTSB | |
| SCHEMBL8533829 | 0.74 | ALDH1A1 (0.61) | ALDH1A1MAPTMMP2MMP9ADAMTS4 | |
| SCHEMBL6021046 | 0.73 | ALDH1A1 (0.73) | ALDH1A1MAPTCTSLCTSKCTSS |
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-5986108-A | ENZYME INHIBITORS | SYNPHAR LABORATORIES, INC. (CA) | 1999-11-16 | — | — | US | disclosed |