Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MYLK | Q15746 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 4/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | GMNN | O75496 | 2/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15917114 | 1.00 | USP2 (0.51) | USP2CYP3A4NFKB1CYP1A2TSHR | |
| SCHEMBL29973515 | 0.84 | TSHR (0.66) | CYP3A4TSHRKMT2ATP53CYP2C9 | |
| SCHEMBL15917236 | 0.84 | TSHR (0.71) | CYP3A4TSHRKMT2ATP53CYP2C9 | |
| SCHEMBL29764343 | 0.83 | CYP3A4 (0.55) | USP2CYP3A4NFKB1CYP1A2TSHR | |
| SCHEMBL15924957 | 0.83 | TSHR (0.51) | CYP3A4TSHRKMT2ACYP2C9MEN1 | |
| SCHEMBL15916754 | 0.82 | TSHR (0.75) | USP2CYP3A4TSHRKMT2ATP53 | |
| SCHEMBL15916530 | 0.82 | TSHR (0.75) | USP2CYP3A4TSHRKMT2ATP53 | |
| SCHEMBL15917823 | 0.82 | PKM (0.54) | CYP3A4TSHRCYP2C9HTR6CYP2C19 | |
| SCHEMBL30610303 | 0.81 | USP2 (0.66) | USP2CYP3A4NFKB1CYP1A2TSHR | |
| SCHEMBL27499027 | 0.81 | TSHR (0.52) | CYP3A4TSHRKMT2ACYP2C9MEN1 |
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-117720528-A | Oxadiazole sulfonamide compound containing pyrazole structure, and preparation method and application thereof | 贵州大学 | 2024-03-19 | — | — | CN | disclosed |