Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Congo Red Free 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 | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.95 |
| ▸ | GLB1 | P16278 | 1/20 | 0.95 |
| ▸ | CHAT | P28329 | 1/20 | 0.95 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.95 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.95 |
| ▸ | CTRC | Q99895 | 1/20 | 0.95 |
| ▸ | SLC7A11 | Q9UPY5 | 2/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.74 |
| ▸ | THRB | P10828 | 2/20 | 0.74 |
| ▸ | HPGD | P15428 | 2/20 | 0.74 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.74 |
| ▸ | RECQL | P46063 | 2/20 | 0.74 |
| ▸ | MEN1 | O00255 | 1/20 | 0.74 |
| ▸ | MAPT | P10636 | 1/20 | 0.74 |
| ▸ | SNCA | P37840 | 1/20 | 0.74 |
| ▸ | BLM | P54132 | 1/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.74 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| Congo Red Free Acid SCHEMBL326085 | 1.00 | APP (0.95) | APPGLB1CHATENPP2PHLPP2 | |
| Congo Red Free Acid SCHEMBL29366109 | 0.97 | APP (1.00) | APPGLB1CHATENPP2PHLPP2 | |
| Congo Red Free Acid SCHEMBL202229 | 0.97 | APP (1.00) | APPGLB1CHATENPP2PHLPP2 | |
| Congo Red Free Acid SCHEMBL29395841 | 0.97 | APP (1.00) | APPGLB1CHATENPP2PHLPP2 | |
| Congo Red Free Acid SCHEMBL25635 | 0.97 | APP (1.00) | APPGLB1CHATENPP2PHLPP2 | |
| SCHEMBL14988500 | 0.91 | APP (0.88) | APPGLB1CHATENPP2PHLPP2 | |
| SCHEMBL14988686 | 0.89 | APP (0.85) | APPGLB1CHATENPP2PHLPP2 | |
| SCHEMBL20553442 | 0.89 | APP (0.84) | APPGLB1CHATENPP2PHLPP2 | |
| SCHEMBL14988379 | 0.87 | APP (0.80) | APPGLB1CHATENPP2PHLPP2 | |
| SCHEMBL14988672 | 0.87 | SLC7A11 (1.00) | APPGLB1CHATENPP2PHLPP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130115257-A1 | COMPOSITIONS AND METHODS FOR REMOVAL OR DESTRUCTION OF AMYLOID FIBRIL OR AMYLOID ADHESIN COMPRISING AGGREGATES | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2013-05-09 | — | — | US | claimed |
| EP-2590658-A2 | COMPOSITIONS AND METHODS FOR REMOVAL OR DESTRUCTION OF AMYLOID FIBRIL OR AMYLOID ADHESIN COMPRISING AGGREGATES | Katholieke Universiteit Leuven (BE) | 2013-05-15 | — | — | EP | disclosed |
| US-20130115257-A1 | COMPOSITIONS AND METHODS FOR REMOVAL OR DESTRUCTION OF AMYLOID FIBRIL OR AMYLOID ADHESIN COMPRISING AGGREGATES | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2013-05-09 | — | — | US | disclosed |
| WO-2012003554-A2 | COMPOSITIONS AND METHODS FOR REMOVAL OR DESTRUCTION OF AMYLOID FIBRIL OR AMYLOID ADHESIN COMPRISING AGGREGATES | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2012-01-12 | — | — | WO | disclosed |