Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.35 |
| ▸ | ADH1C | P00326 | 1/20 | 0.35 |
| ▸ | ADH1A | P07327 | 1/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | ADH7 | P40394 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 4/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 4/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 4/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.30 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL5244 | 0.85 | — | — | |
| SCHEMBL87257 | 0.80 | — | — | |
| SCHEMBL5495 | 0.78 | CYP1A2 (0.40) | SLC1A3SLC1A2SLC1A1PARP15PARP10 | |
| SCHEMBL11224706 | 0.78 | CYP1A2 (0.40) | SLC1A3SLC1A2SLC1A1PARP15PARP10 | |
| SCHEMBL5252 | 0.78 | CYP1A2 (0.40) | SLC1A3SLC1A2SLC1A1PARP15PARP10 | |
| SCHEMBL7739283 | 0.78 | CYP1A2 (0.40) | SLC1A3SLC1A2SLC1A1PARP15PARP10 | |
| SCHEMBL7738618 | 0.78 | CYP1A2 (0.40) | SLC1A3SLC1A2SLC1A1PARP15PARP10 | |
| SCHEMBL12259 | 0.78 | — | — | |
| SCHEMBL3802014 | 0.75 | — | — | |
| SCHEMBL24385596 | 0.74 | LMNA (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104583197-A | New bicyclicpyridine derivatives | HOFFMANN LA ROCHE | 2015-04-29 | — | — | CN | disclosed |