Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 4/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | IGF1R | P08069 | 1/20 | 0.30 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | FLT4 | P35916 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | FLT3 | P36888 | 1/20 | 0.30 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.30 |
| ▸ | TEK | Q02763 | 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 | |
|---|---|---|---|---|
| SCHEMBL5744924 | 0.79 | CYP2A6 (0.48) | NPC1DGAT1EGFRIGF1RSRC | |
| SCHEMBL28840671 | 0.76 | HTR2C (0.48) | HTR2CNPC1HTR2ADGAT1EGFR | |
| SCHEMBL29925168 | 0.76 | HTR2C (0.48) | HTR2CNPC1HTR2ADGAT1EGFR | |
| SCHEMBL4493915 | 0.74 | HTR2C (0.49) | HTR2CNPC1CYP19A1HTR2ADGAT1 | |
| SCHEMBL28840999 | 0.74 | DGAT1 (0.36) | HTR2CNPC1HTR2ADGAT1EGFR | |
| SCHEMBL1467091 | 0.74 | HTR2A (0.49) | HTR2CNPC1HTR2ADGAT1 | |
| SCHEMBL29924680 | 0.74 | DGAT1 (0.36) | HTR2CNPC1HTR2ADGAT1EGFR | |
| SCHEMBL29924782 | 0.74 | HTR2C (0.49) | HTR2CNPC1HTR2ADGAT1 | |
| SCHEMBL29924561 | 0.74 | HTR2C (0.51) | HTR2CHTR2A | |
| SCHEMBL28840665 | 0.74 | HTR2C (0.49) | HTR2CNPC1HTR2ADGAT1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105793252-A | Inhibitors of bruton's tyrosine kinase | 豪夫迈·罗氏有限公司 | 2016-07-20 | — | — | CN | disclosed |