Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.55 |
| ▸ | TDO2 | P48775 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | PARP1 | P09874 | 4/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | QPCT | Q16769 | 1/20 | 0.46 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Benzimidazole SCHEMBL461969 | 0.85 | SMN1; SMN2 (0.50) | IDO1TDO2ALDH1A1SMN1; SMN2PARP1 | |
| Benzimidazole SCHEMBL29358377 | 0.85 | — | — | |
| Benzimidazole SCHEMBL29408372 | 0.85 | — | — | |
| Benzimidazole SCHEMBL10931770 | 0.85 | SMN1; SMN2 (0.50) | IDO1TDO2ALDH1A1SMN1; SMN2PARP1 | |
| Benzimidazole SCHEMBL6009 | 0.85 | — | — | |
| Phthalimide SCHEMBL4702746 | 0.85 | GSK3B (0.54) | IDO1TDO2ALDH1A1POLBRXFP1 | |
| Benzimidazole SCHEMBL28759408 | 0.84 | KDM4E (0.51) | IDO1TDO2ALDH1A1POLBSMN1; SMN2 | |
| Benzimidazole SCHEMBL23673327 | 0.83 | SMN1; SMN2 (0.48) | IDO1TDO2ALDH1A1SMN1; SMN2PARP1 | |
| Benzimidazole SCHEMBL20531480 | 0.83 | SMN1; SMN2 (0.48) | IDO1TDO2ALDH1A1SMN1; SMN2PARP1 | |
| Benzimidazole SCHEMBL21046391 | 0.83 | — | — |
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-108822170-B | Anthraquinone benzimidazole nucleoside analogues and synthesis method and application thereof | 河南师范大学 | 2021-08-20 | — | — | CN | disclosed |
| CN-108822170-B | Anthraquinone benzimidazole nucleoside analogues and synthesis method and application thereof | 河南师范大学 | 2021-08-20 | — | — | CN | disclosed |