Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 6/20 | 0.72 |
| ▸ | IDO1 | P14902 | 6/20 | 0.72 |
| ▸ | MAOA | P21397 | 3/20 | 0.72 |
| ▸ | MAOB | P27338 | 2/20 | 0.72 |
| ▸ | SNCA | P37840 | 2/20 | 0.72 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.72 |
| ▸ | EHMT2 | Q96KQ7 | 2/20 | 0.72 |
| ▸ | AKT1 | P31749 | 1/20 | 0.72 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.72 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.72 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.72 |
| ▸ | MEN1 | O00255 | 6/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.43 |
| ▸ | RECQL | P46063 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | S100A4 | P26447 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | THRB | P10828 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Naphthoquinone SCHEMBL27788134 | 0.92 | IDO1 (0.78) | CDC25BIDO1MAOAMAOBSNCA | |
| SCHEMBL11049520 | 0.85 | CDC25B (0.52) | CDC25BIDO1MAOAMAOBSNCA | |
| SCHEMBL11049537 | 0.85 | CDC25B (0.52) | CDC25BIDO1MAOAMAOBSNCA | |
| SCHEMBL11049499 | 0.85 | CDC25B (0.52) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL8861335 | 0.84 | IDO1 (1.00) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL42139 | 0.84 | IDO1 (1.00) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL11359780 | 0.84 | IDO1 (1.00) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL29354680 | 0.84 | IDO1 (1.00) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL2208241 | 0.81 | CDC25B (0.93) | CDC25BIDO1MAOAMAOBSNCA | |
| Naphthoquinone SCHEMBL11229112 | 0.81 | IDO1 (0.93) | CDC25BIDO1MAOAMAOBSNCA |
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-2835642-B1 | Electron transfer dissociation for biopolymer sequence analysis | UNIV VIRGINIA PATENT FOUNDATION (US) | 2018-01-17 | — | — | EP | disclosed |