Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | BLM | P54132 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | PARP1 | P09874 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4240912 | 1.00 | TDP1 (0.54) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL4240914 | 1.00 | TDP1 (0.54) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL11858226 | 0.86 | TDP1 (0.54) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL11858221 | 0.86 | TDP1 (0.54) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL3140459 | 0.84 | NFE2L2 (0.61) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL29089429 | 0.84 | NFE2L2 (0.61) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL3140451 | 0.84 | NFE2L2 (0.61) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL2675175 | 0.82 | TDP1 (0.50) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL2675176 | 0.82 | TDP1 (0.50) | TDP1TSHRCYP2C19CYP3A4MAPT | |
| SCHEMBL11115897 | 0.82 | NFE2L2 (0.59) | TDP1TSHRCYP2C19CYP3A4MAPT |
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-110615762-A | Synthesis method of ethyl 2,4, 6-triphenylnicotinate | 浙江工业大学 | 2019-12-27 | — | — | CN | disclosed |