Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 1.00 |
| ▸ | TSHR | P16473 | 2/20 | 1.00 |
| ▸ | CYP3A4 | P08684 | 2/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.79 |
| ▸ | RECQL | P46063 | 1/20 | 0.79 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | HTT | P42858 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 3/20 | 0.69 |
| ▸ | HPGD | P15428 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL128274 | 1.00 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL12819436 | 0.98 | ALDH1A1 (0.96) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL13297951 | 0.95 | ALDH1A1 (0.90) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| P-Toluenesulfonamide SCHEMBL28904133 | 0.92 | ALDH1A1 (0.85) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL2372546 | 0.91 | ALDH1A1 (0.83) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL10375728 | 0.89 | ALDH1A1 (0.80) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL19392453 | 0.86 | SMN1; SMN2 (0.79) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| Toluene SCHEMBL27696348 | 0.85 | ALDH1A1 (0.73) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| Bicarbonate SCHEMBL11358602 | 0.84 | ALDH1A1 (0.82) | ALDH1A1TSHRCYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL19392464 | 0.84 | SMN1; SMN2 (0.81) | ALDH1A1TSHRCYP3A4SMN1; 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-117924125-A | Method for preparing sulfonamide derivative through visible light catalysis without metal participation | 苏州大学 | 2024-04-26 | — | — | CN | disclosed |