Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 5/20 | 0.49 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TERT | O14746 | 3/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | PPARG | P37231 | 3/20 | 0.45 |
| ▸ | PPARD | Q03181 | 3/20 | 0.45 |
| ▸ | PPARA | Q07869 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | FABP4 | P15090 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9499436 | 0.90 | FAAH (0.59) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL28005812 | 0.90 | FAAH (0.59) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL28670894 | 0.89 | FAAH (0.57) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL6898037 | 0.84 | FAAH (0.43) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL15758444 | 0.84 | FAAH (0.54) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL935409 | 0.83 | DGKA (0.43) | KDM4EMAPTLMNAPOLBDUSP3 | |
| Oleamide SCHEMBL28407228 | 0.82 | FAAH (0.74) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL28516851 | 0.82 | FAAH (0.51) | FAAHSOAT1CYP1A2CYP2C19KMT2A | |
| SCHEMBL1960961 | 0.81 | DGKA (0.53) | KMT2AMEN1PTPN1PPARGPPARD | |
| SCHEMBL1962326 | 0.81 | DGKA (0.53) | KMT2AMEN1PTPN1PPARGPPARD |
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 |
|---|---|---|---|---|---|---|---|
| CN-117942271-A | Formulations comprising trialkanolamine-based esterquats | 赢创运营有限公司 | 2024-04-30 | — | — | CN | disclosed |
| CN-105434183-B | Formulations comprising esterquat compounds based on isopropanolamine and tetrahydroxypropylethylenediamine | 赢创运营有限公司 | 2021-01-01 | — | — | CN | disclosed |