Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.48 |
| ▸ | CDC25B | P30305 | 3/20 | 0.48 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | AKT1 | P31749 | 1/20 | 0.48 |
| ▸ | SNCA | P37840 | 1/20 | 0.48 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.48 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.48 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.48 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | THRB | P10828 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
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 SCHEMBL27950218 | 0.71 | CDC25B (0.64) | IDO1CDC25BPIN1MAOAMAOB | |
| SCHEMBL3590696 | 0.71 | CDC25B (0.44) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL27788134 | 0.70 | IDO1 (0.78) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL8861335 | 0.69 | IDO1 (1.00) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL11359780 | 0.69 | IDO1 (1.00) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL42139 | 0.69 | IDO1 (1.00) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL29354680 | 0.69 | IDO1 (1.00) | IDO1CDC25BPIN1MAOAMAOB | |
| SCHEMBL19774414 | 0.68 | CDC25B (0.72) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL11229112 | 0.67 | IDO1 (0.93) | IDO1CDC25BPIN1MAOAMAOB | |
| Naphthoquinone SCHEMBL2722901 | 0.67 | IDO1 (0.93) | IDO1CDC25BPIN1MAOAMAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101182321-A | Indolizine heterocyclic nitrogen naphthoquinone derivatives as well as preparation method and anticancer use thereof | UNIV SUN YAT SEN (CN) | 2008-05-21 | — | — | CN | claimed |
| CN-101182321-A | Indolizine heterocyclic nitrogen naphthoquinone derivatives as well as preparation method and anticancer use thereof | UNIV SUN YAT SEN (CN) | 2008-05-21 | — | — | CN | disclosed |