Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 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 SCHEMBL27996977 | 0.85 | TDP1 (0.43) | TDP1EPHX2 | |
| Tert-Butyl Formate SCHEMBL27735920 | 0.84 | TDP1 (0.54) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27647494 | 0.81 | TDP1 (0.50) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27997192 | 0.80 | TDP1 (0.48) | TDP1EPHX2 | |
| Tert-Butyl Formate SCHEMBL27852871 | 0.77 | TDP1 (0.45) | TDP1 | |
| SCHEMBL1717640 | 0.76 | EPHX2 (0.36) | EPHX2IDH1 | |
| Tert-Butyl Formate SCHEMBL27949971 | 0.75 | TDP1 (0.43) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27852257 | 0.75 | TDP1 (0.43) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27935416 | 0.74 | TDP1 (0.42) | TDP1 | |
| Hydrochloric Acid SCHEMBL15550997 | 0.74 | EPHX2 (0.35) | EPHX2IDH1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106255689-B | Heteroaryl SYK Inhibitors | 勃林格殷格翰国际有限公司 | 2019-09-17 | — | — | CN | disclosed |
| CN-110183440-A | Heteroaryl SYK inhibitor | 勃林格殷格翰国际有限公司 | 2019-08-30 | — | — | CN | disclosed |
| CN-106255689-A | Heteroaryl syk inhibitors | 勃林格殷格翰国际有限公司 | 2016-12-21 | — | — | CN | disclosed |