Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.59 |
| ▸ | MEN1 | O00255 | 6/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | MAOA | P21397 | 4/20 | 0.59 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.59 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.59 |
| ▸ | FTO | Q9C0B1 | 4/20 | 0.59 |
| ▸ | XDH | P47989 | 4/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.59 |
| ▸ | CA12 | O43570 | 3/20 | 0.59 |
| ▸ | BCHE | P06276 | 3/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.59 |
| ▸ | ACHE | P22303 | 3/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.59 |
| ▸ | PPARG | P37231 | 3/20 | 0.59 |
| ▸ | CA7 | P43166 | 3/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL118852 | 0.85 | ABCB1 (0.56) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL119434 | 0.81 | MEN1 (0.64) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL174699 | 0.80 | ADORA3 (0.60) | ABCB1CYP3A4MAPTADORA3CYP2D6 | |
| Izalpinin SCHEMBL29974286 | 0.80 | MAOA (0.83) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| Izalpinin SCHEMBL7551775 | 0.80 | MAOA (0.83) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL28106758 | 0.76 | MEN1 (0.67) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| Galangin SCHEMBL117225 | 0.75 | MEN1 (1.00) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| Galangin SCHEMBL29393121 | 0.75 | MEN1 (1.00) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL28106756 | 0.75 | ADORA3 (0.64) | ABCB1MEN1KMT2ACYP3A4MAPT | |
| SCHEMBL5054599 | 0.75 | ABCB1 (0.65) | ABCB1MEN1KMT2ACYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2424541-A2 | PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT | Limerick BioPharma, Inc. (US) | 2012-03-07 | — | — | EP | disclosed |