Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 4/20 | 0.50 |
| ▸ | SCN4A | P35499 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | PPARA | Q07869 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28414828 | 0.86 | SLC6A4 (0.43) | SLC6A4POLBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11858951 | 0.83 | LTA4H (0.47) | PPARGPPARACYP2D6 | |
| SCHEMBL8157398 | 0.81 | SLC6A4 (0.53) | SLC6A4SCN4ASLC6A2SLC6A3IDO1 | |
| SCHEMBL7318173 | 0.78 | SRD5A2 (0.45) | PPARGPPARACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20411153 | 0.77 | SLC7A5 (0.56) | TDP1 | |
| SCHEMBL7311299 | 0.77 | KMT2A (0.61) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13577159 | 0.77 | SLC6A4 (0.41) | SLC6A4IDO1TDO2PPARGPPARA | |
| SCHEMBL5289693 | 0.76 | PPARG (0.49) | SLC6A4SLC6A2SLC6A3PPARGPPARA | |
| SCHEMBL11192850 | 0.76 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3TDP1POLB | |
| SCHEMBL11197372 | 0.76 | NPY5R (0.44) | SLC6A4PPARGPPARANPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1150565-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION bioscience AG (DE) | 2001-11-07 | — | — | EP | claimed |
| WO-2000045635-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2000-08-10 | — | — | WO | claimed |
| EP-1150565-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION bioscience AG (DE) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000045635-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2000-08-10 | — | — | WO | disclosed |