Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18828829 | 0.92 | TP53 (0.33) | TP53TDP1CYP1A2CYP2A6 | |
| SCHEMBL14024535 | 0.78 | TDP1 (0.32) | TP53TDP1CYP1A2CYP2A6 | |
| SCHEMBL18949806 | 0.75 | ALDH1A1 (0.35) | TDP1CYP1A2 | |
| SCHEMBL24977125 | 0.73 | ALDH1A1 (0.32) | CYP1A2CYP2A6 | |
| SCHEMBL15744245 | 0.73 | ALDH1A1 (0.31) | — | |
| SCHEMBL25600480 | 0.71 | TDP1 (0.32) | TP53TDP1CYP1A2CYP2A6 | |
| SCHEMBL15632476 | 0.70 | — | — | |
| SCHEMBL21651170 | 0.70 | — | — | |
| SCHEMBL20718674 | 0.69 | HSD17B10 (0.32) | TP53CYP1A2 | |
| SCHEMBL18899829 | 0.69 | ABL1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2081912-B1 | HETEROCYCLIC BRIDGED BIPHENYLS AND THEIR USE IN OLEDS | BASF SE (DE) | 2016-03-30 | — | — | EP | disclosed |