Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5120839 | 0.90 | MEN1 (0.41) | ALDH1A1TSHRIDO1HPGDMAPK1 | |
| SCHEMBL15328337 | 0.90 | MEN1 (0.36) | ALDH1A1TSHRIDO1TAS2R38CYP2D6 | |
| SCHEMBL5128168 | 0.88 | KDM4E (0.41) | ALDH1A1HPGDMAPK1KMT2A | |
| SCHEMBL15344088 | 0.83 | ALDH1A1 (0.48) | ALDH1A1TSHRIDO1TAS2R38CYP2C19 | |
| SCHEMBL27140354 | 0.81 | ALDH1A1 (0.38) | ALDH1A1TAS2R38HSD17B10HPGD | |
| SCHEMBL4047411 | 0.80 | CYP2D6 (0.45) | ALDH1A1TSHRCYP2D6CYP2C19MAPK1 | |
| SCHEMBL1493634 | 0.77 | — | — | |
| SCHEMBL17234163 | 0.77 | — | — | |
| SCHEMBL4531919 | 0.77 | KDM4E (0.50) | ALDH1A1TSHRIDO1TAS2R38MAPK1 | |
| SCHEMBL31613206 | 0.76 | CYP2D6 (0.43) | ALDH1A1TSHRCYP2D6CYP2C19MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100363362-C | Thiazole derivatives as NPY receptor antagonists | HOFFMANN LA ROCHE (CH) | 2008-01-23 | — | — | CN | disclosed |
| CN-1639158-A | Thiazole derivatives as NPY receptor antagonists | HOFFMANN LA ROCHE (CH) | 2005-07-13 | — | — | CN | disclosed |