Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 8/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.40 |
| ▸ | LMNA | P02545 | 7/20 | 0.40 |
| ▸ | MEN1 | O00255 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | CCR6 | P51684 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520695 | 0.86 | MAPT (0.43) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL29520737 | 0.74 | IDO1 (0.40) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL29520777 | 0.73 | IDO1 (0.39) | IDO1MAPTLMNAHTTNPSR1 | |
| SCHEMBL29520723 | 0.73 | IDO1 (0.39) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL29520290 | 0.72 | IDO1 (0.38) | IDO1MAPTLMNAHTTNPSR1 | |
| SCHEMBL29520721 | 0.68 | MEN1 (0.33) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL18977949 | 0.65 | IDO1 (0.69) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL30816757 | 0.65 | IDO1 (0.69) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL30816758 | 0.65 | IDO1 (0.69) | IDO1MAPTKMT2ALMNAMEN1 | |
| SCHEMBL29520772 | 0.64 | MAPT (0.47) | IDO1MAPTKMT2ALMNAMEN1 |
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-112174901-B | Synthesis method and anticancer activity of 1, 3-benzodiazepine compound | 河南师范大学 | 2022-02-08 | — | — | CN | disclosed |