Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Phenolsulfonic Acid. 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 | |
|---|---|---|---|---|
| ▸ | PTGS1 known ✓ | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | CA2 | P00918 | 5/20 | 0.54 |
| ▸ | CA12 | O43570 | 3/20 | 0.54 |
| ▸ | CA9 | Q16790 | 3/20 | 0.54 |
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.45 |
| ▸ | DUSP5 | Q16690 | 2/20 | 0.45 |
| ▸ | DUSP6 | Q16828 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Phenolsulfonic Acid SCHEMBL11198896 | 1.00 | LMNA (0.56) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL2518118 | 0.97 | LMNA (0.59) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL30756570 | 0.97 | LMNA (0.59) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL1470053 | 0.97 | LMNA (0.59) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL125056 | 0.97 | LMNA (0.59) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL11196801 | 0.97 | LMNA (0.59) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL710820 | 0.95 | LMNA (0.56) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL27472854 | 0.95 | LMNA (0.56) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL10758562 | 0.95 | LMNA (0.56) | LMNACA2CA12CA9CA1 | |
| Phenolsulfonic Acid SCHEMBL7671608 | 0.95 | LMNA (0.56) | LMNACA2CA12CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0609221-B1 | ANTIMICROBIAL DIALDEHYDE COMPOSITION AND METHODS OF USE | ECOLAB INC (US) | 1997-07-30 | — | — | EP | disclosed |
| US-5480643-A | Stable antimicrobial dialdehyde composition and methods of use | ECOLAB INC. (US) | 1996-01-02 | — | — | US | disclosed |
| US-5158778-A | Antiseptics | ECOLAB INC. (US) | 1992-10-27 | — | — | US | disclosed |