Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.46 |
| ▸ | CTSS | P25774 | 3/20 | 0.46 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.38 |
| ▸ | RELA | Q04206 | 2/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8279680 | 0.89 | CTSS (0.49) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL24740517 | 0.84 | CTSS (0.44) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL17373551 | 0.84 | CTSS (0.53) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL6386727 | 0.84 | CTSS (0.53) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL7084925 | 0.82 | CTSS (0.63) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL14151599 | 0.82 | CTSS (0.63) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL6078092 | 0.82 | CTSS (0.63) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL23836574 | 0.81 | CTSS (0.48) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL30557041 | 0.81 | CTSK (0.48) | CTSKCTSSAAK1NFKB1NFKB2 | |
| SCHEMBL26573222 | 0.80 | CTSS (0.49) | CTSKCTSSAAK1NFKB1NFKB2 |
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-2005113580-A1 | ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES AND MATERIALS FOR THEIR SYNTHESIS | PFIZER INC. (US) | 2005-12-01 | — | — | WO | disclosed |