Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 8/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 7/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 3/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 3/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12918131 | 0.93 | ABCB1 (0.40) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL12893115 | 0.90 | ABCB1 (0.38) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL2323461 | 0.81 | ABCB1 (0.45) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL1259555 | 0.79 | MAPT (0.51) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL2329785 | 0.75 | MAPT (0.42) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL19833677 | 0.72 | TP53 (0.67) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL30888820 | 0.72 | TP53 (0.67) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL17940134 | 0.71 | MAPT (0.49) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL17353582 | 0.68 | MAPT (0.53) | ABCB1MAPTKDM4ECYP3A4MEN1 | |
| SCHEMBL14697042 | 0.65 | MEN1 (0.61) | ABCB1MAPTKDM4ECYP3A4MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7880021-B2 | reacting 6-bromomethyl-4'-(diethylamino)-3-hydroxyflavone with dodecylmethylamine to form the corresponding tertiary amine (4'-(diethylamino)-6-(dodecyl(methyl)aminomethyl)-3-hydroxyflavone); and reacting the product of step a. with propansultone; use in biomembrane studies; Alzheimer's disease, cancer | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2011-02-01 | — | — | US | disclosed |