Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL4772850 | 0.90 | — | — | |
| Isopropyl Alcohol SCHEMBL28655743 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL28376616 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL8814180 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL1807773 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL6031064 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL1279486 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL358027 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRTDP1TP53 | |
| Isopropyl Alcohol SCHEMBL1677605 | 0.86 | ALDH1A1 (0.55) | ALDH1A1LMNATSHRTDP1 | |
| Isopropyl Alcohol SCHEMBL4237313 | 0.86 | ALDH1A1 (0.55) | ALDH1A1LMNATSHRTDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6765076-B2 | OF FORMULA M(O2)N, WHERE M IS A TRANSITION METAL AND N IS EQUAL TO THE VALENCE OF M, ARE USED AS INITIATORS FOR FREE RADICAL POLYMERIZATION; OPTIONALLY, CHAIN TRANSFER AGENTS, E.G., DITHIOCARBOXYLATES OR TRITHIOCARBONATES | RENSSELAER POLYTECHNIC INSTITUTE | 2004-07-20 | — | — | US | disclosed |
| US-20030060577-A1 | Of formula M(O2)n, where M is a transition metal and n is equal to the valence of M, are used as initiators for free radical polymerization; optionally, chain transfer agents, e.g., dithiocarboxylates or trithiocarbonates | RENSSELAER POLYTECHNIC INSTITUTE | 2003-03-27 | — | — | US | disclosed |