Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 3/20 | 0.35 |
| ▸ | BAK1 | Q16611 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665960 | 0.93 | — | — | |
| SCHEMBL606320 | 0.93 | — | — | |
| SCHEMBL17937883 | 0.90 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Ammonia Solution, Strong SCHEMBL9722924 | 0.90 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| SCHEMBL888528 | 0.90 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Heptane SCHEMBL8332734 | 0.88 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Octane SCHEMBL8328270 | 0.88 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Cyclohexane SCHEMBL8329975 | 0.86 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Cyclopentane SCHEMBL8333113 | 0.86 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Alcohol SCHEMBL8828863 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CYP3A4TSHRTDP1CA2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5490944-A | BLEND OF A QUATERNARY AMMONIUM SALT AND AN AMIDO IMIDAZOLINIUM COMPOUND DISSOLVED IN WATER | COLGATE-PALMOLIVE COMPANY (US) | 1996-02-13 | — | — | US | disclosed |
| EP-0315126-A2 | Liquid softergent formulations having improved stability and softening properties | Colgate-Palmolive Company (US) | 1989-05-10 | — | — | EP | disclosed |
| EP-0161262-B1 | QUATERNARY AMMONIUM SALTS USEFUL AS FABRIC SOFTENERS | AKZO N.V. (NL) | 1987-08-12 | — | — | EP | disclosed |
| US-4675118-A | Quaternary ammonium salts useful as fabric softeners | AKZONA INCORPORATED (US) | 1987-06-23 | — | — | US | disclosed |
| US-4569800-A | A TALLOW ALKYL DIMETHYL AMMONIUM SALT; CLEAR AND COLORLESS TRUE SOLUTIONS | AKZONA INCORPORATED (US) | 1986-02-11 | — | — | US | disclosed |
| EP-0161262-A4 | QUATERNARY AMMONIUM SALTS USEFUL AS FABRIC SOFTENERS. | AKZONA INC (US) | 1985-12-05 | — | — | EP | disclosed |
| EP-0161262-A1 | QUATERNARY AMMONIUM SALTS USEFUL AS FABRIC SOFTENERS. | AKZONA INC (US) | 1985-11-21 | — | — | EP | disclosed |
| WO-1985000617-A1 | QUATERNARY AMMONIUM SALTS USEFUL AS FABRIC SOFTENERS | AKZONA INCORPORATED (US) | 1985-02-14 | — | — | WO | disclosed |