Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4165991 | 0.87 | CTRB1 (0.48) | SLC6A2SLC6A3KMT2ATDP1CTRB1 | |
| SCHEMBL8458225 | 0.87 | CTRB1 (0.48) | SLC6A2SLC6A3KMT2ATDP1CTRB1 | |
| SCHEMBL3051941 | 0.87 | ALDH1A1 (0.46) | SLC6A2SLC6A3KMT2ATDP1CTRB1 | |
| SCHEMBL7415557 | 0.84 | CTRB1 (0.45) | CTRB1ALDH1A1MAPK1CYP1A2MAPT | |
| SCHEMBL2721341 | 0.84 | CTRB1 (0.45) | CTRB1ALDH1A1MAPK1CYP1A2MAPT | |
| SCHEMBL9307089 | 0.83 | CTRB1 (0.49) | SLC6A2SLC6A3KMT2ATDP1CTRB1 | |
| SCHEMBL15559017 | 0.82 | TDP1 (0.49) | SLC6A2SLC6A3KMT2ATDP1ABCB1 | |
| SCHEMBL27528611 | 0.81 | SLC6A2 (0.40) | SLC6A2SLC6A3KMT2ATDP1CTRB1 | |
| SCHEMBL5229233 | 0.81 | ALDH1A1 (0.49) | SLC6A2SLC6A3KMT2ATDP1ABCB1 | |
| SCHEMBL2494968 | 0.81 | ITGB3 (0.59) | SLC6A2SLC6A3KMT2ATDP1CTRB1 |
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-2005010011-A2 | METHODS OF SYNTHESIS OF ACYLOXYALKYL COMPOUNDS | XENOPORT, INC. (US) | 2005-02-03 | — | — | WO | disclosed |