Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 3/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | AURKA | O14965 | 6/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 6/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.32 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27186394 | 0.89 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2ACCNE2CCNE1 | |
| SCHEMBL27186192 | 0.88 | ALDH1A1 (0.34) | ALDH1A1MEN1KMT2ACCNE2CCNE1 | |
| SCHEMBL30853390 | 0.71 | EGFR (0.37) | PARP1GAAHSP90AA1NNMT | |
| SCHEMBL30853331 | 0.69 | JAK2 (0.39) | ALDH1A1AURKARPS6KB1KDM4EPOLB | |
| SCHEMBL5110866 | 0.69 | CYP2C19 (0.50) | ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL30853312 | 0.68 | PARP1 (0.31) | PARP1 | |
| SCHEMBL5110256 | 0.68 | SLC6A4 (0.42) | ALDH1A1MEN1KMT2A | |
| SCHEMBL30853351 | 0.67 | PARP1 (0.43) | ALDH1A1PARP1AURKARPS6KB1KDM4E | |
| SCHEMBL30853319 | 0.67 | BRD4 (0.37) | PARP1CCNE2CCNE1CDK2KDM4E | |
| SCHEMBL27186991 | 0.65 | HSD17B10 (0.50) | ALDH1A1KDM4EMAPTTDP1 |
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-117651701-A | Novel substituted bicyclic aza heterocycles as SOS1 inhibitors | 唯久生物技术(苏州)有限公司 | 2024-03-05 | — | — | CN | disclosed |