Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 9/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1161458 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| SCHEMBL13676644 | 0.84 | MET (0.46) | ALDH1A1NPC1POLBRAB9AMET | |
| SCHEMBL1329537 | 0.84 | CASP6 (0.45) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| Ammonia Solution, Strong SCHEMBL28864710 | 0.83 | MET (0.46) | ALDH1A1NPC1POLBRAB9AMET | |
| SCHEMBL3150247 | 0.82 | MEN1 (0.50) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| SCHEMBL22743880 | 0.82 | MET (0.42) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| Hydrochloric Acid SCHEMBL20563713 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| SCHEMBL27796690 | 0.81 | MET (0.42) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| SCHEMBL3407645 | 0.81 | CASP6 (0.57) | ALDH1A1CASP1MEN1CASP7KMT2A | |
| SCHEMBL5833750 | 0.81 | NPC1 (0.54) | ALDH1A1CASP1MEN1CASP7KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115515956-A | Benzimidazole derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2022-12-23 | — | — | CN | disclosed |