Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.31 |
| ▸ | GNAI3 | P08754 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28289845 | 0.93 | TDP1 (0.46) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27947184 | 0.93 | TDP1 (0.46) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27731450 | 0.86 | TDP1 (0.52) | TDP1LMNACYP3A4GABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL27473155 | 0.84 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28092916 | 0.84 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28331255 | 0.84 | TDP1 (0.68) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27637918 | 0.84 | TDP1 (0.50) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27562943 | 0.84 | TDP1 (0.50) | TDP1LMNACYP3A4GABRA1TSHR | |
| Tert-Butyl Formate SCHEMBL28256721 | 0.82 | TDP1 (0.65) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27606011 | 0.82 | TDP1 (0.65) | TDP1 |
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-109563043-A | SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 | 葛兰素史密斯克莱知识产权发展有限公司 | 2019-04-02 | — | — | CN | disclosed |