Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT1 | P35610 | 1/20 | 0.38 |
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 10/20 | 0.35 |
| ▸ | CNR1 | P21554 | 8/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 4/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9480599 | 1.00 | SOAT1 (0.38) | SOAT1FASNCNR2CNR1PPARG | |
| SCHEMBL455193 | 0.85 | — | — | |
| SCHEMBL232854 | 0.85 | — | — | |
| SCHEMBL866509 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL712887 | 0.83 | PPARG (0.36) | PPARGPPARDPPARAFAAH | |
| SCHEMBL8091033 | 0.78 | CNR2 (0.38) | SOAT1CNR2CNR1PPARGPPARD | |
| SCHEMBL8091035 | 0.78 | CNR2 (0.38) | SOAT1CNR2CNR1PPARGPPARD | |
| SCHEMBL8533019 | 0.78 | CNR2 (0.38) | SOAT1CNR2CNR1PPARGPPARD | |
| SCHEMBL12594514 | 0.77 | ABCC4 (0.34) | — | |
| SCHEMBL20334817 | 0.77 | CTH (0.35) | FASNPPARGPPARDPPARAFAAH |
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-5252745-A | Preparation and use of iodopropargyl esters of α-amino acid derivatives as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1993-10-12 | — | — | US | disclosed |
| EP-0414533-A1 | Use of iodopropargyl esters of alpha-amino acid derivatives as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1991-02-27 | — | — | EP | disclosed |