Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 2/20 | 0.33 |
| ▸ | BCR | P11274 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL314917 | 1.00 | CYP2A6 (0.38) | CYP2A6ABL1BCRCYP11B2 | |
| SCHEMBL2410743 | 0.88 | ABL1 (0.39) | CYP2A6ABL1BCR | |
| SCHEMBL2410744 | 0.88 | ABL1 (0.39) | CYP2A6ABL1BCR | |
| SCHEMBL3395491 | 0.88 | CYP3A4 (0.34) | CYP2A6 | |
| SCHEMBL315175 | 0.88 | CYP3A4 (0.34) | CYP2A6 | |
| SCHEMBL316176 | 0.87 | ABL1 (0.31) | ABL1CYP11B2 | |
| SCHEMBL316178 | 0.87 | ABL1 (0.31) | ABL1CYP11B2 | |
| SCHEMBL2141252 | 0.85 | XDH (0.38) | CYP11B2 | |
| SCHEMBL2141249 | 0.85 | XDH (0.38) | CYP11B2 | |
| SCHEMBL315640 | 0.85 | PIK3CG (0.32) | CYP2A6CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2066683-B1 | DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT | FOURNIER LAB SA (FR) | 2010-11-03 | — | — | EP | disclosed |