Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | MARK3 | P27448 | 1/20 | 0.33 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29128580 | 0.84 | ALDH1A1 (0.46) | HTTALDH1A1TP53CYP1A2CYP2D6 | |
| SCHEMBL29128564 | 0.81 | KDM4E (0.53) | ALDH1A1TSHRTDP1SMN1; SMN2KDM4E | |
| SCHEMBL29128339 | 0.79 | USP2 (0.32) | HTTALDH1A1TDP1SMN1; SMN2KDM4E | |
| SCHEMBL29128476 | 0.77 | DPYD (0.33) | HTTALDH1A1TDP1KDM4EMAPT | |
| SCHEMBL29128504 | 0.76 | SLC6A4 (0.36) | HTTALDH1A1TSHRTDP1SMN1; SMN2 | |
| SCHEMBL29128287 | 0.76 | DPYD (0.30) | — | |
| SCHEMBL29128467 | 0.76 | ADRA1D (0.34) | HTTALDH1A1TP53SMN1; SMN2KDM4E | |
| SCHEMBL29128250 | 0.75 | CTSS (0.33) | HTTALDH1A1TDP1MAPTKMT2A | |
| SCHEMBL29128516 | 0.75 | MAPT (0.35) | HTTALDH1A1CYP2D6KDM4EMAPT | |
| SCHEMBL29128178 | 0.72 | KDM4E (0.37) | HTTALDH1A1TP53SMN1; SMN2KDM4E |
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-117263862-A | Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof | 吉首大学 | 2023-12-22 | — | — | CN | disclosed |