Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20889268 | 0.77 | NOS3 (0.43) | KDM4EMEN1MAPTTHRBKMT2A | |
| SCHEMBL13592845 | 0.76 | MAP3K14 (0.53) | CYP2D6SLC6A2SLC6A4TP53MAP3K14 | |
| SCHEMBL29955655 | 0.75 | MEN1 (0.37) | TP53MAP3K14KDM4EMEN1MAPT | |
| SCHEMBL19682790 | 0.75 | MEN1 (0.37) | TP53MAP3K14KDM4EMEN1MAPT | |
| SCHEMBL30456278 | 0.74 | CYP19A1 (0.38) | CYP2D6TP53MAP3K14KDM4EMEN1 | |
| SCHEMBL25723204 | 0.74 | CYP19A1 (0.38) | CYP2D6TP53MAP3K14KDM4EMEN1 | |
| SCHEMBL2479116 | 0.74 | CHRNB4 (0.36) | TP53MAP3K14KDM4EMEN1MAPT | |
| SCHEMBL2047603 | 0.74 | MAP3K14 (0.40) | MAOAMAP3K14THRBBCHEACHE | |
| SCHEMBL19827781 | 0.72 | CTSB (0.35) | SLC6A2SLC6A4TP53CTSBGABRA1 | |
| SCHEMBL12677304 | 0.72 | CYP2C9 (0.39) | MAP3K14KDM4ECYP2C9 |
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-2004103998-A1 | QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2004-12-02 | — | — | WO | disclosed |