Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 3/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17594971 | 0.99 | LMNA (0.39) | ALDH1A1L3MBTL1LMNAPARP1PARP2 | |
| SCHEMBL17594868 | 0.87 | KIF11 (0.38) | ALDH1A1L3MBTL1LMNAPARP1PARP2 | |
| SCHEMBL17594969 | 0.86 | KIF11 (0.39) | ALDH1A1LMNAPARP1PARP2SIRT2 | |
| SCHEMBL17595142 | 0.85 | ABCB1 (0.39) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL14745803 | 0.82 | DCTPP1 (0.40) | ALDH1A1LMNAPARP1PARP2SIRT2 | |
| SCHEMBL17595256 | 0.82 | PDE3B (0.35) | ALDH1A1LMNAMAPTPDE3BPDE3A | |
| SCHEMBL17594967 | 0.82 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1LMNAPDE3BPDE3A | |
| SCHEMBL14747044 | 0.81 | KIF11 (0.41) | ALDH1A1L3MBTL1LMNAPARP1PARP2 | |
| SCHEMBL14745564 | 0.80 | KIF11 (0.42) | ALDH1A1PARP1PARP2SIRT2SIRT1 | |
| SCHEMBL17595374 | 0.79 | AURKA (0.33) | PDE3BPDE3AEZH2 |
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-2016039936-A2 | MONOCYCLIC SUBSTITUTED 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-03-17 | — | — | WO | claimed |