Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.41 |
| ▸ | CTSS | P25774 | 6/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13934290 | 0.87 | CTSK (0.53) | CTSKCTSSCYP2D6CYP1A2CYP2C9 | |
| SCHEMBL13921058 | 0.83 | CTSK (0.55) | CTSKCTSSCYP2D6CA1CA2 | |
| SCHEMBL13921043 | 0.83 | CTSK (0.55) | CTSKCTSSCYP2D6CA1CA2 | |
| SCHEMBL16383458 | 0.82 | CYP1A2 (0.51) | CTSKCTSSCYP2D6CYP1A2CYP2C9 | |
| SCHEMBL13921030 | 0.79 | CA1 (0.47) | CTSKCTSSCYP2D6CA1CA2 | |
| SCHEMBL13921009 | 0.79 | CA1 (0.47) | CTSKCTSSCYP2D6CA1CA2 | |
| SCHEMBL13921025 | 0.79 | CTSK (0.50) | CTSKCTSSCA2CTSLCTSB | |
| SCHEMBL13921014 | 0.79 | CTSK (0.50) | CTSKCTSSCA2CTSLCTSB | |
| SCHEMBL15462624 | 0.78 | SMN1; SMN2 (0.49) | CTSKCTSSCYP2D6CA1CA2 | |
| SCHEMBL13921041 | 0.78 | CTSS (0.55) | CTSKCTSSCA2HTT |
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-7498353-B2 | Heterocyclic anti-viral compounds comprising metabolizable moieties and their uses | RIGEL PHARMACEUTICALS, INC. (US) | 2009-03-03 | — | — | US | disclosed |