Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Lauryl Isoquinolinium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 11/20 | 0.79 |
| ▸ | HTT | P42858 | 1/20 | 0.97 |
| ▸ | BCHE | P06276 | 13/20 | 0.79 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL11872576 | 1.00 | HTT (0.97) | HTTBCHEACHE | |
| Iodide SCHEMBL11872583 | 0.98 | HTT (0.93) | HTTBCHEACHE | |
| SCHEMBL9421767 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| SCHEMBL1963054 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| Lauryl Isoquinolinium SCHEMBL1067310 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| SCHEMBL3902995 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| SCHEMBL1412713 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| SCHEMBL9512245 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| SCHEMBL30771513 | 0.98 | HTT (1.00) | HTTBCHEACHE | |
| Iodide SCHEMBL10749215 | 0.98 | HTT (0.93) | HTTBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008034178-A1 | TOPICAL DEPILATING COMPOSITION | IEMMA SALVATORE (AU) | 2008-03-27 | — | — | WO | claimed |
| WO-2008034178-A1 | TOPICAL DEPILATING COMPOSITION | IEMMA SALVATORE (AU) | 2008-03-27 | — | — | WO | disclosed |