Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.33 |
| ▸ | CLPP | Q16740 | 3/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6703428 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2ANCOA1 | |
| SCHEMBL6822444 | 0.84 | NAMPT (0.40) | ALDH1A1KDM4EMEN1KMT2ANCOA1 | |
| Picolamine SCHEMBL6818745 | 0.81 | S1PR3 (0.40) | ALDH1A1KDM4EMEN1KMT2ATSHR | |
| SCHEMBL6700327 | 0.78 | CLPP (0.43) | ALDH1A1CLPPPOLB | |
| SCHEMBL6700576 | 0.71 | CLPP (0.39) | MAPK1CLPPTLR7PARP1PARP2 | |
| SCHEMBL6699940 | 0.70 | MAPK1 (0.34) | ALDH1A1MAPK1BRD4CLPPPOLB | |
| SCHEMBL6700986 | 0.70 | MAPK1 (0.36) | ALDH1A1TSHRL3MBTL1MAPK1BRD4 | |
| SCHEMBL6699350 | 0.68 | P2RX7 (0.35) | MAPK1CYP3A4 | |
| SCHEMBL6697984 | 0.65 | ALDH1A1 (0.36) | ALDH1A1TSHRL3MBTL1MAPK1 | |
| SCHEMBL6813649 | 0.64 | KDM5A (0.36) | ALDH1A1KDM4EMEN1KMT2ANCOA1 |
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-2004014916-A1 | PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | claimed |