Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1059568 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHR | |
| SCHEMBL3880928 | 0.79 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1 | |
| Tert-Butyl Hydroperoxide SCHEMBL788774 | 0.67 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1 | |
| Tert-Butyl Hydroperoxide SCHEMBL20212 | 0.67 | — | — | |
| Tert-Butyl Hydroperoxide SCHEMBL8377296 | 0.67 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1 | |
| SCHEMBL7086003 | 0.67 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL93337 | 0.67 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1 | |
| Tert-Butyl Hydroperoxide SCHEMBL5962734 | 0.67 | ALDH1A1 (0.75) | ALDH1A1TSHRTDP1 | |
| Tert-Butyl Hydroperoxide SCHEMBL2821344 | 0.64 | — | — | |
| SCHEMBL4299706 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5951458-A | TOPICAL APPLYING OXIDIZER TO BLOOD VESSEL WALLS | SCIMED LIFE SYSTEMS, INC. (US) | 1999-09-14 | — | — | US | disclosed |
| US-4242473-A | BRANCHED BROMO-SUBSTITUTED POLYPHENYLENE ETHERS | VELSICOL CHEMICAL CORPORATION (US) | 1980-12-30 | — | — | US | disclosed |
| US-4141880-A | POLYPHENYLENE ETHER FROM BROMINATED PHENOL | VELSICOL CHEMICAL CORPORATION (US) | 1979-02-27 | — | — | US | disclosed |