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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 4/20 | 0.39 |
| ▸ | LAP3 | P28838 | 2/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 5/20 | 0.37 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.36 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28085531 | 1.00 | TP53 (0.46) | TP53FDPSLAP3SMPD1SPHK1 | |
| Sulfuric Acid Dimethyl Ester SCHEMBL27633967 | 0.91 | TP53 (0.42) | TP53FDPSLAP3SMPD1SPHK1 | |
| SCHEMBL26929110 | 0.89 | TP53 (0.47) | TP53LAP3SMPD1SPHK1ZDHHC7 | |
| SCHEMBL14840204 | 0.89 | TP53 (0.47) | TP53LAP3SMPD1SPHK1ZDHHC7 | |
| SCHEMBL10822298 | 0.89 | TP53 (0.47) | TP53LAP3SMPD1SPHK1ZDHHC7 | |
| SCHEMBL4623738 | 0.89 | TP53 (0.50) | TP53FDPSLAP3SMPD1SPHK1 | |
| SCHEMBL28441527 | 0.85 | TP53 (0.44) | TP53FDPSLAP3SPHK1ZDHHC7 | |
| SCHEMBL10944415 | 0.85 | SPHK1 (0.47) | TP53FDPSLAP3SPHK1S1PR2 | |
| SCHEMBL238536 | 0.85 | SPHK1 (0.47) | TP53FDPSLAP3SPHK1S1PR2 | |
| SCHEMBL28359730 | 0.85 | SPHK1 (0.47) | TP53FDPSLAP3SPHK1S1PR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4267077-A | CATIONIC SURFACTANT, ANIONIC SURFACTANT AND A SOLVENT; SOFTENING AND ANTISTATIC | KAO SOAP CO., LTD. (JP) | 1981-05-12 | — | — | US | claimed |
| CN-103561712-B | The method processing keratin fiber under heat inputs | 莱雅公司 | 2016-08-17 | — | — | CN | disclosed |
| US-4267077-A | CATIONIC SURFACTANT, ANIONIC SURFACTANT AND A SOLVENT; SOFTENING AND ANTISTATIC | KAO SOAP CO., LTD. (JP) | 1981-05-12 | — | — | US | disclosed |