Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | STAT3 | P40763 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LIPE | Q05469 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 4/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7214874 | 0.83 | L3MBTL1 (0.58) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL12862698 | 0.77 | MAPT (0.53) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| Ammonia Solution, Strong SCHEMBL28403781 | 0.75 | MAPT (0.51) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL26985270 | 0.74 | AOC3 (0.55) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL10101799 | 0.74 | MAPT (0.47) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL15373873 | 0.73 | AOC3 (0.44) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| Propionic Acid SCHEMBL29144216 | 0.73 | AOC3 (0.47) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL28749497 | 0.72 | AOC3 (0.52) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL112286 | 0.72 | P4HTM (0.44) | AOC3L3MBTL1MAPTMAPK1TDP1 | |
| SCHEMBL15064968 | 0.71 | AOC3 (0.59) | AOC3L3MBTL1MAPTMAPK1TDP1 |
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-6503898-B1 | Administering 4,7-dibenzyl-5,6-dihydroxy-N,N*-di(m-aminobenzyl)--1,3-diazepin-2-one or salt to treat human immunodeficiency virus infection | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-01-07 | — | — | US | disclosed |