Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31413127 | 0.84 | ABL1 (0.42) | ABL1ALDH1A1HPGDHTTMAPT | |
| SCHEMBL25321193 | 0.84 | ABL1 (0.42) | ABL1ALDH1A1HPGDHTTMAPT | |
| SCHEMBL24947160 | 0.83 | RARA (0.46) | ALDH1A1MAPTLMNATP53SMN1; SMN2 | |
| SCHEMBL12566233 | 0.82 | ALDH1A1 (0.40) | ABL1ALDH1A1HPGDHTTMAPT | |
| SCHEMBL24947181 | 0.78 | CFTR (0.43) | ALDH1A1HPGDLMNAMAPK1HSD17B10 | |
| SCHEMBL28731299 | 0.78 | GAA (0.44) | ALDH1A1HPGDMAPTKMT2ALMNA | |
| SCHEMBL8787683 | 0.77 | KDM4E (0.45) | ALDH1A1HPGDHTTMAPTMEN1 | |
| SCHEMBL12566234 | 0.76 | GSK3B (0.47) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL74506 | 0.76 | PDE4A (0.46) | ALDH1A1MAPTLMNAMAPK1KDM4E | |
| SCHEMBL29164216 | 0.76 | ALDH1A1 (0.47) | ABL1ALDH1A1HPGDHTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023000834-A1 | BENZIMIDAZOLE OR AZABENZIMIDAZOLE-6-CARBOXYLIC ACID COMPOUND AND USE THEREOF | 广州必贝特医药股份有限公司 | 2023-01-26 | — | — | WO | disclosed |