Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.31 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.31 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.31 |
| ▸ | KCNQ1 | P51787 | 2/20 | 0.31 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL14007418 | 0.76 | KDM4E (0.33) | ALDH1A1KCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL25231546 | 0.75 | BACE1 (0.33) | KCNQ3KCNQ2KCNE1KCNQ1KCNQ5 | |
| SCHEMBL28723884 | 0.74 | KCNQ3 (0.40) | ALDH1A1KCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL12895625 | 0.72 | CHEK1 (0.37) | ALOX5 | |
| SCHEMBL12883375 | 0.72 | HDAC3 (0.31) | ALOX5 | |
| SCHEMBL335743 | 0.71 | SRC (0.35) | ALDH1A1 | |
| SCHEMBL7352511 | 0.71 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL31129254 | 0.70 | SMN1; SMN2 (0.41) | ALDH1A1KCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL19444177 | 0.69 | SMN1; SMN2 (0.48) | ALDH1A1 | |
| SCHEMBL25715615 | 0.69 | ALDH1A1 (0.32) | ALDH1A1 |
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-2008005956-A2 | PYRROLOTRIAZINE KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-10 | — | — | WO | disclosed |