Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.50 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL995685 | 0.90 | — | — | |
| Trimethylammonium SCHEMBL16161251 | 0.78 | ALDH1A1 (0.46) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| Trimethylammonium SCHEMBL27755091 | 0.78 | CHRNB2 (0.52) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| SCHEMBL16244490 | 0.76 | TSHR (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| Trimethylammonium SCHEMBL3458977 | 0.76 | CHRNB2 (0.50) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| SCHEMBL28293534 | 0.76 | CHRNB2 (0.42) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| SCHEMBL7765958 | 0.75 | — | — | |
| SCHEMBL427586 | 0.73 | — | — | |
| SCHEMBL17399540 | 0.73 | CHRNB2 (0.52) | CHRNB2CHRNA4CHRNB4CHRNA3CHRM2 | |
| SCHEMBL1766714 | 0.73 | — | — |
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-4125628-A | FORMALDEHYDE, QUATERNARY AMMONIUM SALT | VINELAND LABORATORIES, INC. (US) | 1978-11-14 | — | — | US | disclosed |
| US-4022911-A | Disinfectant composition comprising a quaternary ammonium compound, a phenol, and formaldehyde | DAMON CORPORATION (US) | 1977-05-10 | — | — | US | disclosed |