Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.40 |
| ▸ | PI4KA | P42356 | 1/20 | 0.40 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.40 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2585957 | 1.00 | DHFR (0.50) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL19786204 | 0.94 | DHFR (0.44) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL28576110 | 0.92 | GAA (0.44) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL2585614 | 0.91 | MEN1 (0.46) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL30507756 | 0.91 | MEN1 (0.46) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL19013468 | 0.91 | ALDH1A1 (0.46) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL2586996 | 0.90 | MAPT (0.52) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL2631757 | 0.89 | MEN1 (0.48) | DHFRMEN1KMT2AMAPTGAA | |
| SCHEMBL19013006 | 0.88 | DHFR (0.44) | DHFRMEN1KMT2ARXFP1MAPT | |
| SCHEMBL19012889 | 0.88 | DHFR (0.44) | DHFRMEN1KMT2ARXFP1MAPT |
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-113214254-B | Hole-transport-type main body material, preparation method thereof and application thereof in preparation of organic electroluminescent device | 华南理工大学 | 2022-07-26 | — | — | CN | disclosed |