Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Cetrimonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 12/20 | 0.55 |
| ▸ | HTT | P42858 | 4/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | RAD52 | P43351 | 2/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6557962 | 0.97 | DNM1 (0.52) | DNM1HTTHSP90AA1RAD52APAF1 | |
| Hydrochloric Acid SCHEMBL7154617 | 0.97 | DNM1 (0.55) | DNM1HTTHSP90AA1RAD52APAF1 | |
| SCHEMBL7767862 | 0.93 | HTT (0.60) | DNM1HTTHSP90AA1RAD52LMNA | |
| SCHEMBL10806075 | 0.93 | HTT (0.60) | DNM1HTTHSP90AA1RAD52LMNA | |
| SCHEMBL10420709 | 0.93 | HTT (0.60) | DNM1HTTHSP90AA1RAD52LMNA | |
| SCHEMBL25414052 | 0.93 | DNM1 (0.60) | DNM1HTTHSP90AA1RAD52APAF1 | |
| SCHEMBL6895464 | 0.93 | DNM1 (0.60) | DNM1HTTHSP90AA1RAD52APAF1 | |
| SCHEMBL238047 | 0.93 | DNM1 (0.60) | DNM1HTTHSP90AA1RAD52APAF1 | |
| SCHEMBL1547985 | 0.93 | HTT (0.60) | DNM1HTTHSP90AA1RAD52LMNA | |
| SCHEMBL5880997 | 0.93 | HTT (0.60) | DNM1HTTHSP90AA1RAD52LMNA |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0290676-B1 | Improved disinfectant polymeric coatings for hard surfaces | ECOLAB INC (US) | 1994-08-17 | — | — | EP | disclosed |
| EP-0290739-B1 | IMPROVED DISINFECTANT POLYMERIC COATINGS FOR HARD SURFACES | ECOLAB INC. (US) | 1993-02-10 | — | — | EP | disclosed |
| US-5154920-A | Adherent, water-resistant | ECOLAB INC. (US) | 1992-10-13 | — | — | US | disclosed |
| US-5061485-A | Film forming acrylic polymer | ECOLAB INC. (US) | 1991-10-29 | — | — | US | disclosed |
| EP-0194770-B1 | DISINFECTANT POLYMERIC COATINGS FOR HARD SURFACES | ECOLAB INC. (US) | 1991-07-17 | — | — | EP | disclosed |
| US-4999386-A | Germicidal agent contained in polymer film, sustained release | ECOLAB INC. (US) | 1991-03-12 | — | — | US | disclosed |
| US-4883828-A | Disinfectant polymeric coatings for hard surfaces | ECOLAB INC. (US) | 1989-11-28 | — | — | US | disclosed |
| EP-0290739-A2 | Improved disinfectant polymeric coatings for hard surfaces | ECOLAB INC. (US) | 1988-11-17 | — | — | EP | disclosed |
| EP-0290676-A2 | Improved disinfectant polymeric coatings for hard surfaces | ECOLAB INC. (US) | 1988-11-17 | — | — | EP | disclosed |
| EP-0194770-A2 | Disinfectant polymeric coatings for hard surfaces | ECOLAB INC. (US) | 1986-09-17 | — | — | EP | disclosed |