Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 15/20 | 0.53 |
| ▸ | HTR2A | P28223 | 5/20 | 0.53 |
| ▸ | DRD2 | P14416 | 4/20 | 0.53 |
| ▸ | HTR7 | P34969 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28312482 | 0.87 | HTR6 (0.48) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL25599716 | 0.86 | HTR6 (0.42) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL6039554 | 0.86 | HTR6 (0.58) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL29429815 | 0.85 | HTR6 (0.56) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL6039811 | 0.85 | HTR6 (0.56) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL6039808 | 0.84 | HTR6 (0.55) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL20190392 | 0.84 | HTR6 (0.54) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL23152049 | 0.80 | HTR6 (0.49) | HTR6HTR2ADRD2HTR7CYP3A4 | |
| SCHEMBL17542583 | 0.79 | EGFR (0.49) | CYP3A4MEN1KMT2ALMNA | |
| SCHEMBL30337269 | 0.79 | EGFR (0.49) | CYP3A4MEN1KMT2ALMNA |
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-110036004-A | Inhibitors of cyclin dependent kinase 7(CDK7) | 希洛斯医药品股份有限公司 | 2019-07-19 | — | — | CN | disclosed |