Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18076003 | 0.82 | ELANE (0.40) | ELANEKDM4EATMTDP1NPC1 | |
| SCHEMBL29448528 | 0.82 | MAPT (0.44) | ELANEKDM4EATMTDP1NPC1 | |
| SCHEMBL14976 | 0.82 | MAPT (0.44) | ELANEKDM4EATMTDP1NPC1 | |
| SCHEMBL30949796 | 0.80 | MAPT (0.43) | ELANEKDM4EATMTDP1NPC1 | |
| Hydrogen Peroxide SCHEMBL8974942 | 0.80 | TDP1 (0.46) | ELANEKDM4EATMTDP1NPC1 | |
| Styrene SCHEMBL10531750 | 0.80 | TDP1 (0.41) | CYP3A4ELANEKDM4EATMTDP1 | |
| SCHEMBL10723585 | 0.79 | CYP3A4 (0.34) | CYP3A4ELANEKDM4ETSHRALDH1A1 | |
| Acetic Acid SCHEMBL28044565 | 0.77 | TDP1 (0.44) | ELANEKDM4EATMTDP1NPC1 | |
| SCHEMBL166714 | 0.77 | NPC1 (0.41) | CYP3A4ELANETDP1NPC1TSHR | |
| SCHEMBL10723596 | 0.76 | PTPN1 (0.30) | — |
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-0219900-B1 | T-ALKENYL PEROXY ESTERS AND THEIR USE AS INITIATORS AND CURING AGENTS | AKZO N.V. (NL) | 1990-09-12 | — | — | EP | claimed |