Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 5/20 | 0.34 |
| ▸ | CNR1 | P21554 | 5/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | CTSC | P53634 | 1/20 | 0.31 |
| ▸ | STAT6 | P42226 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6252183 | 0.88 | JAK2 (0.35) | JAK2JAK1CTSC | |
| SCHEMBL2924445 | 0.70 | DGAT1 (0.36) | JAK2JAK1 | |
| SCHEMBL6252505 | 0.67 | — | — | |
| SCHEMBL6250638 | 0.67 | CNR1 (0.39) | CNR2ANO1CNR1CTSC | |
| SCHEMBL4246964 | 0.67 | CTSL (0.37) | CTSC | |
| SCHEMBL4239023 | 0.67 | CTSL (0.34) | CTSC | |
| SCHEMBL5361109 | 0.66 | CTSS (0.35) | CNR2ANO1CNR1CTSC | |
| SCHEMBL6194995 | 0.66 | DGAT1 (0.40) | — | |
| SCHEMBL5361057 | 0.66 | CTSS (0.35) | CNR1CTSC | |
| SCHEMBL4247124 | 0.65 | CTSL (0.37) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1569954-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004052921-A1 | CYANOMETHYL DERIVATIVES AS CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2004-06-24 | — | — | WO | disclosed |