Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 5/20 | 0.38 |
| ▸ | BRD4 | O60885 | 4/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8572979 | 1.00 | CYP1A2 (0.43) | CYP1A2POLBCYP3A4CYP2C19RIPK1 | |
| SCHEMBL3948769 | 0.90 | SRC (0.40) | CYP1A2POLBCYP3A4CYP2C19SRC | |
| SCHEMBL20783314 | 0.90 | SRC (0.40) | CYP1A2POLBCYP3A4CYP2C19SRC | |
| SCHEMBL19674208 | 0.88 | HSD17B10 (0.40) | SRCBRD4HSD11B1TP53NAMPT | |
| SCHEMBL19540703 | 0.87 | HSD11B1 (0.38) | SRCBRD4HSD11B1TP53NAMPT | |
| SCHEMBL3389544 | 0.87 | JAK2 (0.38) | SRCBRD4HSD11B1TP53NAMPT | |
| SCHEMBL263737 | 0.87 | JAK2 (0.38) | SRCBRD4HSD11B1TP53NAMPT | |
| SCHEMBL7807928 | 0.85 | BRD4 (0.39) | SRCBRD4HSD11B1NR1H2NR1H3 | |
| SCHEMBL3952747 | 0.85 | BRD4 (0.39) | SRCBRD4HSD11B1NR1H2NR1H3 | |
| SCHEMBL7800302 | 0.84 | ECE1 (0.37) | SRCBRD4HSD11B1TP53MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009026197-A1 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LIMITED (GB) | 2009-02-26 | — | — | WO | disclosed |
| WO-2009026197-A1 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LIMITED (GB) | 2009-02-26 | — | — | WO | disclosed |