Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1355001 | 0.91 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CYP2C9CYP2C19 | |
| SCHEMBL21702403 | 0.85 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL20602091 | 0.84 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL12465315 | 0.77 | MAPT (0.42) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL4693009 | 0.77 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL6774653 | 0.74 | TSHR (0.52) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL3811153 | 0.74 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3SLC1A3SLC1A2 | |
| SCHEMBL22183791 | 0.74 | TAAR1 (0.44) | MEN1CYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL24038017 | 0.73 | CYP2C19 (0.54) | SLC6A2SLC6A3CYP2C9CYP2C19MEN1 | |
| SCHEMBL21915824 | 0.73 | CYP2C19 (0.54) | SLC6A2SLC6A3CYP2C9CYP2C19MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1296973-B1 | GUANIDINE DERIVATIVES OF QUINAZOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES | ASTRAZENECA AB (SE) | 2008-11-05 | — | — | EP | claimed |