Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MDM4 | O15151 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25026458 | 0.79 | POLB (0.35) | ALDH1A1SLC40A1HTR2AHTR2C | |
| SCHEMBL25026453 | 0.78 | ABL1 (0.34) | ALDH1A1SLC40A1HTR2AHTR2C | |
| SCHEMBL25027174 | 0.76 | ALDH1A1 (0.42) | ALDH1A1SLC40A1KMT2ASMN1; SMN2LMNA | |
| SCHEMBL31053833 | 0.76 | ALDH1A1 (0.42) | ALDH1A1SLC40A1KMT2ASMN1; SMN2LMNA | |
| SCHEMBL11874548 | 0.73 | ALDH1A1 (0.52) | ALDH1A1SLC40A1KMT2ASMN1; SMN2TP53 | |
| SCHEMBL24119880 | 0.72 | ALDH1A1 (0.54) | ALDH1A1SLC40A1KMT2ASMN1; SMN2TP53 | |
| SCHEMBL8407103 | 0.71 | GAA (0.59) | ALDH1A1SLC40A1KMT2ASMN1; SMN2TP53 | |
| SCHEMBL31053832 | 0.70 | ALDH1A1 (0.47) | ALDH1A1KMT2ASMN1; SMN2TP53LMNA | |
| SCHEMBL31053862 | 0.69 | GAA (0.45) | ALDH1A1SLC40A1KMT2ALMNAMEN1 | |
| SCHEMBL25027280 | 0.69 | GAA (0.45) | ALDH1A1SLC40A1KMT2ALMNAMEN1 |
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-118475567-A | Heterocyclic derivative, composition and pharmaceutical application thereof | 西藏海思科制药有限公司 | 2024-08-09 | — | — | CN | disclosed |
| WO-2023016518-A1 | HETEROCYCLIC DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF | 四川海思科制药有限公司 | 2023-02-16 | — | — | WO | disclosed |